methyl 11-(acetyloxy)-12-ethyl-4-[16-ethyl-12-(methoxycarbonyl)-1,10-diazatetracyclo[12.3.1.0³,¹¹.0?,?]octadeca-3(11),4,6,8,15-pentaen-12-yl]-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.0¹,?.0²,?.0¹?,¹?]nonadeca-2(7),3,5,13-tetraene-10-carboxylate
AlkaPlorer ID: AK003869
Synonym: None
IUPAC Name: methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-4-[(12S,14R)-16-ethyl-12-methoxycarbonyl-1,10-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8,15-pentaen-12-yl]-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate
Structure
SMILES: CCC1=C[C@@H]2CN(C1)CC1=C(NC3=CC=CC=C13)[C@@](C(=O)OC)(C1=CC3=C(C=C1OC)N(C)[C@H]1[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]4(CC)C=CCN5CC[C@]31[C@@H]54)C2
InChI: InChI=1S/C45H54N4O8/c1-8-27-19-28-22-44(40(51)55-6,36-30(25-48(23-27)24-28)29-13-10-11-14-33(29)46-36)32-20-31-34(21-35(32)54-5)47(4)38-43(31)16-18-49-17-12-15-42(9-2,37(43)49)39(57-26(3)50)45(38,53)41(52)56-7/h10-15,19-21,28,37-39,46,53H,8-9,16-18,22-25H2,1-7H3/t28-,37-,38+,39+,42+,43+,44-,45-/m0/s1
InChIKey: GBABOYUKABKIAF-IELIFDKJSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Anacolosa clarkii | Anacolosa | Aptandraceae | Santalales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 778.9469999999999
TPSA？: 133.87
MolLogP？: 4.753600000000004
Number of H-Donors: 2
Number of H-Acceptors: 11
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 14125.4 | nM | None |
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 52673.2 | nM | None |
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 55560.0 | nM | None |
| Bos taurus | Progesterone receptor | IC50 | nan | None | None |
| Bos taurus | Progesterone receptor | Ki | nan | None | None |
| Cavia porcellus | Leukotriene C4 synthase | IC50 | nan | None | None |
| Cavia porcellus | Leukotriene C4 synthase | Ki | nan | None | None |
| Cavia porcellus | Serotonin 4 (5-HT4) receptor | IC50 | nan | None | None |
| Cavia porcellus | Serotonin 4 (5-HT4) receptor | Ki | nan | None | None |
| Chlorocebus sabaeus | Vero C1008 | CC50 | 14500.0 | nM | 10.6019/CHEMBL4651402 |
| Chlorocebus sabaeus | Vero C1008 | pCC50 | 4.84 | None | 10.6019/CHEMBL4651402 |
| Cryptosporidium parvum | Cryptosporidium parvum | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Electrophorus electricus | Acetylcholinesterase | Inhibition | -0.32 | % | 10.1016/j.bmc.2012.09.040 |
| Entamoeba histolytica | Entamoeba histolytica | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Equus caballus | Cholinesterase | Inhibition | 12.23 | % | 10.1016/j.bmc.2012.09.040 |
| Giardia intestinalis | Putative fructose-1,6-bisphosphate aldolase | Potency | 17740.7 | nM | None |
| Homo sapiens | 23132-87 | IC50 | 6.945 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 5637 | IC50 | 7.552 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 639-V | IC50 | 6.609 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 647-V | IC50 | 20.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 697 | IC50 | 4.228 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 769-P | IC50 | 16.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 786-0 | IC50 | 2.992 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 8305C | IC50 | 4.919 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 8505C | IC50 | 4.419 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 8-MG-BA | IC50 | 3.375 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A101D | IC50 | 8.674 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A 172 | IC50 | 13.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A204 | IC50 | 3.208 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A2058 | IC50 | 3.503 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A253 cell line | IC50 | 1.223 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A2780 | IC50 | 6.382 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A-375 | IC50 | 38.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A388 | IC50 | 6.067 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A3-KAW | IC50 | 21.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A-427 | IC50 | 3.103 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A-431 | IC50 | 2.897 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A-431 | IC50 | 60.0 | nM | 10.1021/jm101388d |
| Homo sapiens | A498 | IC50 | 26.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A4-Fuk | IC50 | 4.035 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A549 | Activity | 2.66 | None | 10.1016/j.bmc.2007.05.045 |
| Homo sapiens | A549 | GI | 55.9 | % | 10.1016/j.bmcl.2012.10.024 |
| Homo sapiens | A549 | IC50 | 9.0 | nM | 10.1016/j.bmcl.2012.10.024 |
| Homo sapiens | A549 | IC50 | 10.0 | nM | 10.1016/j.bmcl.2012.03.082 |
| Homo sapiens | A549 | IC50 | 30.0 | nM | 10.1021/np900157t |
| Homo sapiens | A549 | IC50 | 36.9 | nM | 10.1021/np800284h |
| Homo sapiens | A549 | IC50 | 49.0 | nM | 10.1016/j.bmc.2007.05.045 |
| Homo sapiens | A549 | IC50 | 64.6 | nM | 10.1021/jm101388d |
| Homo sapiens | A549 | IC50 | 600.0 | nM | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | A549 | IC50 | 26100.0 | nM | 10.1021/np100086x |
| Homo sapiens | A549 | Inhibition | 75.9 | % | 10.1016/j.bmc.2007.05.045 |
| Homo sapiens | A673 | IC50 | 7.268 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A673 | TGI | 6.0 | nM | 10.1021/acs.jnatprod.8b01015 |
| Homo sapiens | A704 | IC50 | 5841.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ABC-1 | IC50 | 3.024 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Acetylcholinesterase | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Acetylcholinesterase | IC50 | nan | None | None |
| Homo sapiens | Acetylcholinesterase | Ki | nan | None | None |
| Homo sapiens | ACHN | IC50 | 45.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ACN | IC50 | 1.329 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Adenosine A1 receptor | IC50 | nan | None | None |
| Homo sapiens | Adenosine A1 receptor | Ki | nan | None | None |
| Homo sapiens | Adenosine A2a receptor | IC50 | nan | None | None |
| Homo sapiens | Adenosine A2a receptor | Ki | nan | None | None |
| Homo sapiens | Adenosine A3 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Adenosine A3 receptor | IC50 | nan | None | None |
| Homo sapiens | Adenosine A3 receptor | Ki | nan | None | None |
| Homo sapiens | AGS | IC50 | 6.462 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ALL-PO | IC50 | 3.359 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Alpha-1a adrenergic receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Alpha-1d adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Alpha-1d adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Alpha-2a adrenergic receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Alpha-2a adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Alpha-2a adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Alpha-2b adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Alpha-2b adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Alpha-2c adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Alpha-2c adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | AM-38 | IC50 | 33.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | AN3-CA | IC50 | 6.269 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Androgen Receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Angiotensin II type 2 (AT-2) receptor | IC50 | nan | None | None |
| Homo sapiens | Angiotensin II type 2 (AT-2) receptor | Ki | nan | None | None |
| Homo sapiens | ARH-77 | IC50 | 17.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ASPC1 | IC50 | 1360.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ATN-1 | IC50 | 1.943 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | AU565 | IC50 | 8.185 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BB30-HNC | IC50 | 0.3988 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BB49-HNC | IC50 | 209.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BB65-RCC | IC50 | 61.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BC-3 | IC50 | 31.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BCPAP | IC50 | 2.978 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BE-13 | IC50 | 12.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Becker | IC50 | 5.391 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BEN | IC50 | 58.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Beta-1 adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Beta-1 adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Beta-2 adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Beta-2 adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | Beta-3 adrenergic receptor | IC50 | nan | None | None |
| Homo sapiens | Beta-3 adrenergic receptor | Ki | nan | None | None |
| Homo sapiens | BFTC-905 | IC50 | 3.622 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BFTC-909 | IC50 | 10.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BHT-101 | IC50 | 513.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BHY | IC50 | 9.946 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BL-41 | IC50 | 5.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BL-70 | IC50 | 3.164 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BOKU | IC50 | 195.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BPH-1 | IC50 | 1.899 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Bradykinin B2 receptor | IC50 | nan | None | None |
| Homo sapiens | Bradykinin B2 receptor | Ki | nan | None | None |
| Homo sapiens | BT-20 | IC50 | 12.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BT-474 | IC50 | 28.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BV-173 | IC50 | 30.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BXPC-3 | IC50 | 3.901 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C2BBe1 | IC50 | 101.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C32 | IC50 | 1118.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C-33-A | IC50 | 7.314 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C3A | IC50 | 209.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C-4-II | IC50 | 23.01 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C8166 | IC50 | 17.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CA46 | IC50 | 22.17 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Ca9-22 | IC50 | 10.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAKI-1 | IC50 | 1271.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-120 | IC50 | 43.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-12T | IC50 | 20.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-148 | IC50 | 15.4 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-27 | IC50 | 32.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-33 | Activity | 9.96 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | CAL-33 | Activity | 17.62 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | CAL-33 | Activity | 24.44 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | CAL-33 | Activity | 49.16 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | CAL-33 | IC50 | 5.021 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-39 | IC50 | 4.258 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-51 | IC50 | 8.613 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-54 | IC50 | 126.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-62 | IC50 | 8.183 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-72 | IC50 | 618.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-85-1 | IC50 | 4.904 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Calcitonin receptor | IC50 | nan | None | None |
| Homo sapiens | Calcitonin receptor | Ki | nan | None | None |
| Homo sapiens | Calu-1 | IC50 | 516.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Calu-3 | IC50 | 18.0 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Calu-6 | IC50 | 5.701 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAMA-1 | IC50 | 45.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Cannabinoid CB1 receptor | IC50 | nan | None | None |
| Homo sapiens | Cannabinoid CB1 receptor | Ki | nan | None | None |
| Homo sapiens | Caov-3 cell line | IC50 | 71.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Caov-4 | IC50 | 1222.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAPAN-1 | IC50 | 14.18 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Capan-2 | IC50 | 30.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CaR-1 | IC50 | 59.07 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Carbonic anhydrase II | IC50 | nan | None | None |
| Homo sapiens | Carbonic anhydrase II | Ki | nan | None | None |
| Homo sapiens | CAS-1 | IC50 | 40.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Ca-Ski | IC50 | 19.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Caspase-1 | IC50 | nan | None | None |
| Homo sapiens | Caspase-1 | Ki | nan | None | None |
| Homo sapiens | Cathepsin G | IC50 | nan | None | None |
| Homo sapiens | Cathepsin G | Ki | nan | None | None |
| Homo sapiens | C-C chemokine receptor type 2 | IC50 | nan | None | None |
| Homo sapiens | C-C chemokine receptor type 2 | Ki | nan | None | None |
| Homo sapiens | C-C chemokine receptor type 4 | IC50 | nan | None | None |
| Homo sapiens | C-C chemokine receptor type 4 | Ki | nan | None | None |
| Homo sapiens | C-C chemokine receptor type 5 | IC50 | nan | None | None |
| Homo sapiens | C-C chemokine receptor type 5 | Ki | nan | None | None |
| Homo sapiens | CCF-STTG1 | IC50 | 8.373 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CCRF-CEM | IC50 | 4.555 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CESS | IC50 | 5.043 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CGTH-W-1 | IC50 | 0.2316 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ChaGo-K-1 | IC50 | 6.686 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CHL-1 | IC50 | 4.595 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Cholecystokinin A receptor | IC50 | nan | None | None |
| Homo sapiens | Cholecystokinin A receptor | Ki | nan | None | None |
| Homo sapiens | CHP-126 | IC50 | 96.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CHP-212 | IC50 | 24.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CMK | IC50 | 13.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO 205 | IC50 | 1.368 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-320-HSR | IC50 | 521.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-668 | IC50 | 28.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-678 | IC50 | 189.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-679 | IC50 | 1.832 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-680N | IC50 | 53.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-684 | IC50 | 13.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-741 | IC50 | 35.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-792 | IC50 | 220.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-800 | IC50 | 16.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-824 | IC50 | 47.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-829 | IC50 | 0.1051 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L105 | IC50 | 30.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L23 | IC50 | 9.886 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L279 | IC50 | 118.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L88 | IC50 | 34.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CP50-MEL-B | IC50 | 43.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CP66-MEL | IC50 | 45.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CPC-N | IC50 | 318.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CTB-1 | IC50 | 19.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CTV-1 | IC50 | 5.011 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CW-2 | IC50 | 9324.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CWR22R | IC50 | 8.787 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Cyclooxygenase-1 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Cyclooxygenase-1 | IC50 | nan | None | None |
| Homo sapiens | Cyclooxygenase-1 | Ki | nan | None | None |
| Homo sapiens | Cyclooxygenase-2 | IC50 | nan | None | None |
| Homo sapiens | Cyclooxygenase-2 | Ki | nan | None | None |
| Homo sapiens | Cysteinyl leukotriene receptor 1 | IC50 | nan | None | None |
| Homo sapiens | Cysteinyl leukotriene receptor 1 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 1A2 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 1A2 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2A6 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2A6 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2C19 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2C19 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2C9 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2C9 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2D6 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2D6 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 2E1 | IC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 2E1 | Ki | nan | None | None |
| Homo sapiens | Cytochrome P450 3A4 | Activity | nan | None | None |
| Homo sapiens | Cytochrome P450 3A4 | IC50 | 1000.0 | nM | None |
| Homo sapiens | Cytochrome P450 3A4 | Ki | nan | None | None |
| Homo sapiens | D-247MG | IC50 | 12.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-263MG | IC50 | 505.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D283 Med | IC50 | 642.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-336MG | IC50 | 63.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-392MG | IC50 | 65.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-502MG | IC50 | 82.63 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-542MG | IC50 | 83.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Daoy | IC50 | 6.646 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Daudi | IC50 | 84.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DB | IC50 | 19.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DBTRG-05MG | IC50 | 3.885 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DEL | IC50 | 3.63 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Delta opioid receptor | IC50 | nan | None | None |
| Homo sapiens | Delta opioid receptor | Ki | nan | None | None |
| Homo sapiens | Detroit 562 | IC50 | 7.549 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DG-75 | IC50 | 82.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DJM-1 | IC50 | 15.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DK-MG | IC50 | 6445.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-114 | IC50 | 401.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-153 | IC50 | 350.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-273 | IC50 | 2.707 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-53 | IC50 | 916.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-79 | IC50 | 537.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DOHH-2 | IC50 | 5.039 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DOK | IC50 | 115.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Dopamine D1 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Dopamine D1 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D1 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine D2 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D2 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine D3 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Dopamine D3 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D3 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine D4 receptor | IC50 | nan | None | None |
| Homo sapiens | Dopamine D4 receptor | Ki | nan | None | None |
| Homo sapiens | Dopamine transporter | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Dopamine transporter | IC50 | nan | None | None |
| Homo sapiens | Dopamine transporter | Ki | nan | None | None |
| Homo sapiens | DoTc2-4510 | IC50 | 3.593 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DSH1 | IC50 | 4.868 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DU-145 | IC50 | 4.814 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DU-4475 | IC50 | 48.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DV-90 | IC50 | 34.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EB2 | IC50 | 6.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EB-3 | IC50 | 440.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ECC12 | IC50 | 0.509 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ECC4 | IC50 | 189.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EC-GI-10 | IC50 | 122.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFE-184 | IC50 | 316.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFM-19 | IC50 | 6.035 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFO-21 | IC50 | 21.71 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFO-27 | IC50 | 5.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EGI-1 | IC50 | 129.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EHEB | IC50 | 90.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EKVX | IC50 | 287.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EM-2 | IC50 | 44.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Endothelin receptor ET-A | IC50 | nan | None | None |
| Homo sapiens | Endothelin receptor ET-A | Ki | nan | None | None |
| Homo sapiens | EOL1 | IC50 | 9.086 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Epidermal growth factor receptor erbB1 | IC50 | nan | None | None |
| Homo sapiens | Epidermal growth factor receptor erbB1 | Ki | nan | None | None |
| Homo sapiens | ES1 | IC50 | 3.778 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES3 | IC50 | 28.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES4 | IC50 | 146.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES5 | IC50 | 4158.35 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES6 | IC50 | 42.4 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES7 | IC50 | 3.856 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES8 | IC50 | 2.719 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ESS-1 | IC50 | 9.136 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Estrogen receptor alpha | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Estrogen receptor alpha | IC50 | nan | None | None |
| Homo sapiens | Estrogen receptor alpha | Ki | nan | None | None |
| Homo sapiens | Estrogen receptor beta | IC50 | nan | None | None |
| Homo sapiens | Estrogen receptor beta | Ki | nan | None | None |
| Homo sapiens | ETK-1 | IC50 | 6.921 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EVSA-T | IC50 | 275.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-1 | IC50 | 3.934 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-11 | IC50 | 42.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-13 | IC50 | 6.617 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-16 | IC50 | 4.348 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-18 | IC50 | 7.046 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-24 | IC50 | 274.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-3 | IC50 | 182.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-7 | IC50 | 16.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | FaDu | IC50 | 48.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | FTC-133 | IC50 | 309.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | G-361 | IC50 | 3.525 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | G-401 | IC50 | 7.874 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | G-402 | IC50 | 32.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GAK | IC50 | 102.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GAMG | IC50 | 13.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Gamma-aminobutyric acid receptor subunit alpha-1/alpha-2/beta-2/gamma-2 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | GB-1 | IC50 | 189.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GCIY | IC50 | 57.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GCT | IC50 | 50.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GDM-1 | IC50 | 24.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GI-1 | IC50 | 3.536 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GI-ME-N | IC50 | 5.755 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Glucocorticoid receptor | IC50 | nan | None | None |
| Homo sapiens | Glucocorticoid receptor | Ki | nan | None | None |
| Homo sapiens | GMS-10 | IC50 | 128.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GOTO | IC50 | 70.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GP5d | IC50 | 7.841 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GR-ST | IC50 | 8.272 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GT3TKB | IC50 | 0.7477 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | H4 | IC50 | 7.851 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HAL-01 | IC50 | 3941.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HC-1 | IC50 | 3.887 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1143 | IC50 | 438.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1187 | IC50 | 13.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1395 | IC50 | 15.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1419 | IC50 | 396.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1569 | IC50 | 4.932 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1599 | IC50 | 10.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1806 | IC50 | 23.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1937 | IC50 | 117.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1937 | IC50 | 10000.0 | nM | 10.1016/j.bmcl.2015.03.081 |
| Homo sapiens | HCC1937 | Inhibition | 0.0 | % | 10.1016/j.bmcl.2015.03.081 |
| Homo sapiens | HCC1954 | IC50 | 10.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC2157 | IC50 | 18.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC2218 | IC50 | 57.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC 2998 | IC50 | 5.045 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC38 | IC50 | 4.872 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC70 | IC50 | 30.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCE-4 | IC50 | 20.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCE-T | IC50 | 1153.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCT-116 | Activity | nan | None | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HCT-116 | IC50 | 3.373 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCT-116 | IC50 | 14.9 | nM | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HCT-116 | IC50 | 35.0 | nM | 10.1021/jm4004347 |
| Homo sapiens | HCT-116 | IC50 | 35.0 | nM | 10.1021/jm500530v |
| Homo sapiens | HCT-116 | IC50 | 75.0 | nM | 10.1021/jm3014376 |
| Homo sapiens | HCT-116 | Inhibition | 13.01 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HCT-116 | Inhibition | 28.49 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HCT-116 | Inhibition | 50.94 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HCT-116 | Inhibition | nan | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HCT-116/VM46 | IC50 | 600.0 | nM | 10.1021/jm3014376 |
| Homo sapiens | HCT-15 | IC50 | 1223.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HDLM-2 | IC50 | 15.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HD-MY-Z | IC50 | 29.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HEC-1 | IC50 | 22.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HEL | IC50 | 38.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HeLa | GI50 | 2.7 | nM | 10.1016/j.bmcl.2008.12.077 |
| Homo sapiens | HeLa | IC50 | 9.0 | nM | 10.1016/j.bmcl.2012.03.082 |
| Homo sapiens | HeLa | IC50 | 26.0 | nM | 10.1016/j.bmc.2007.05.045 |
| Homo sapiens | HeLa | IC50 | 26.9 | nM | 10.1021/np800284h |
| Homo sapiens | HeLa | IC50 | 27.0 | nM | 10.1016/j.bmcl.2011.10.114 |
| Homo sapiens | HeLa | IC50 | 27.0 | nM | 10.1021/np900157t |
| Homo sapiens | Hep293TT | TGI | 80.0 | nM | 10.1021/acs.jnatprod.8b01015 |
| Homo sapiens | HepG2 | Activity | nan | None | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HepG2 | IC50 | 110.0 | nM | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HepG2 | IC50 | 23120.0 | nM | 10.1016/j.bmcl.2015.09.039 |
| Homo sapiens | HepG2 | Inhibition | 11.7 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HepG2 | Inhibition | 33.1 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HepG2 | Inhibition | 47.41 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HepG2 | Inhibition | nan | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | HERG | AC50 | 5500.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | HERG | IC50 | nan | None | None |
| Homo sapiens | HERG | Ki | nan | None | None |
| Homo sapiens | HGC-27 | IC50 | 1.852 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HH | IC50 | 8.879 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Histamine H1 receptor | IC50 | nan | None | None |
| Homo sapiens | Histamine H1 receptor | Ki | nan | None | None |
| Homo sapiens | Histamine H2 receptor | IC50 | nan | None | None |
| Homo sapiens | Histamine H2 receptor | Ki | nan | None | None |
| Homo sapiens | Histamine H3 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Histone acetyltransferase GCN5 | Potency | 25118.9 | nM | None |
| Homo sapiens | Histone deacetylase 6 | Inhibition | -4.06 | % | 10.6019/CHEMBL4808148 |
| Homo sapiens | Histone deacetylase 6 | Inhibition | 10.04 | % | 10.6019/CHEMBL4808148 |
| Homo sapiens | HL-60 | Activity | nan | None | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | HL-60 | IC50 | 60.0 | nM | 10.1021/np100086x |
| Homo sapiens | HL-60 | IC50 | 106.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HL-60 | IC50 | 11470.0 | nM | 10.1016/j.bmcl.2015.09.039 |
| Homo sapiens | HLE | IC50 | 10.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HMG-CoA reductase | IC50 | nan | None | None |
| Homo sapiens | HMG-CoA reductase | Ki | nan | None | None |
| Homo sapiens | HMV-2 cell line | IC50 | 4.768 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HN | IC50 | 1434.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HO-1-N-1 | IC50 | 6.652 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Homo sapiens | CL | 20.0 | mL.min-1.kg-1 | 10.1021/jm900403j |
| Homo sapiens | Homo sapiens | CL_renal | 2.2 | mL.min-1.kg-1 | 10.1021/jm900403j |
| Homo sapiens | Homo sapiens | DILI_Concern | nan | None | 10.1016/j.drudis.2016.02.015 |
| Homo sapiens | Homo sapiens | DILI_severity_class | 3.0 | None | 10.1016/j.drudis.2016.02.015 |
| Homo sapiens | Homo sapiens | Fabs | 45.0 | % | 10.1124/dmd.110.034629 |
| Homo sapiens | HOP-62 | IC50 | 1.927 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HOP-92 | IC50 | 51.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HOS | IC50 | 3.218 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HPAF-II | IC50 | 16.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Hs-578T | IC50 | 2455.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HSC-2 | IC50 | 2.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HSC-3 | IC50 | 5.619 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HSC-4 | IC50 | 627.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT | IC50 | 21.58 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-1080 | IC50 | 2.495 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT1197 | IC50 | 132.4 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-1376 | IC50 | 31.46 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-144 | IC50 | 0.5909 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-29 | Activity | 1.39 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | HT-29 | Activity | 3.41 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | HT-29 | Activity | 21.42 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | HT-29 | Activity | 72.85 | % | 10.1016/j.ejmech.2012.10.051 |
| Homo sapiens | HT-29 | IC50 | 3.236 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-29 | IC50 | 11.9 | nM | 10.1021/jm101388d |
| Homo sapiens | HT-3 | IC50 | 128.29 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT55 | IC50 | 1727.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HTC-C3 | IC50 | 26.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuCCT-1 | IC50 | 2.778 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Huh-7 | IC50 | 29.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuO-3N1 | IC50 | 12.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuO9 | IC50 | 7.092 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuP-T3 | IC50 | 256.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuP-T4 | IC50 | 37.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuTu80 | IC50 | 2.177 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HUVEC | IC50 | 2.0 | nM | 10.1021/jm4004347 |
| Homo sapiens | IA-LM | IC50 | 3.713 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IGR-1 | IC50 | 1.903 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IGROV-1 | IC50 | 2.202 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IM-9 | IC50 | 545.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IMR-5 | IC50 | 11.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Interleukin-8 receptor A | IC50 | nan | None | None |
| Homo sapiens | Interleukin-8 receptor A | Ki | nan | None | None |
| Homo sapiens | Interleukin-8 receptor B | IC50 | nan | None | None |
| Homo sapiens | Interleukin-8 receptor B | Ki | nan | None | None |
| Homo sapiens | IPC-298 | IC50 | 36.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-MEL1 | IC50 | 155.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-MES1 | IC50 | 532.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-SL1 | IC50 | 39.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-SL2 | IC50 | 17.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | J82 | IC50 | 97.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JAR | IC50 | 94.2 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JEG-3 | IC50 | 14.07 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JIYOYE | IC50 | 10.73 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | J-RT3-T3-5 | IC50 | 6.831 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JVM-2 | IC50 | 8397.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JVM-3 | IC50 | 292.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | K052 | IC50 | 21.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | K5 | IC50 | 41.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | K562 | IC50 | 3.5 | nM | 10.1021/jm500530v |
| Homo sapiens | K562 | IC50 | 6.0 | nM | 10.1016/j.bmcl.2015.02.045 |
| Homo sapiens | K562 | IC50 | 6.0 | nM | 10.1021/np500170v |
| Homo sapiens | K562 | IC50 | 20.0 | nM | 10.1021/jm4004347 |
| Homo sapiens | K562 | IC50 | 3299.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KALS-1 | IC50 | 3.897 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Kappa opioid receptor | IC50 | nan | None | None |
| Homo sapiens | Kappa opioid receptor | Ki | nan | None | None |
| Homo sapiens | KARPAS-299 | IC50 | 67.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KARPAS-422 | IC50 | 23.29 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KARPAS-45 | IC50 | 5.735 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Kasumi 1 | IC50 | 17.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KB | EC50 | 6.0 | nM | 10.1021/jm101388d |
| Homo sapiens | KB | IC50 | 1.0 | nM | 10.1021/jm801064y |
| Homo sapiens | KB | IC50 | 40.0 | nM | 10.1021/jm801064y |
| Homo sapiens | KE-37 | IC50 | 4.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KG-1 | IC50 | 105.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KGN | IC50 | 7.051 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KINGS-1 | IC50 | 72.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KLE | IC50 | 173.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KM12 | IC50 | 2.606 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KM-H2 | IC50 | 9.108 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KMOE-2 | IC50 | 136.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KMS-12-PE | IC50 | 60.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KNS-42 | IC50 | 8.028 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KNS-81-FD | IC50 | 807.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KOSC-2 | IC50 | 74.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KP-4 | IC50 | 2.711 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KP-N-YS | IC50 | 21.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KS-1 | IC50 | 1.466 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KU-19-19 | IC50 | 1115.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KU812 cell line | IC50 | 9.301 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KURAMOCHI | IC50 | 2.814 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KY821 | IC50 | 472.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-140 | IC50 | 23.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-150 cell line | IC50 | 3.039 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-180 | IC50 | 7.134 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-270 | IC50 | 3.156 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-410 | IC50 | 6.213 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-450 | IC50 | 9.741 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-510 | IC50 | 4.188 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-520 cell line | IC50 | 17.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-70 cell line | IC50 | 16.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | L-363 | IC50 | 12.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | L-428 | IC50 | 105.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | L-540 | IC50 | 30.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LAMA-84 | IC50 | 45.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LAN-6 | IC50 | 1424.58 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB1047-RCC | IC50 | 85.58 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB2241-RCC | IC50 | 352.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB2518-MEL | IC50 | 210.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB373-MEL-D | IC50 | 46.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB647-SCLC | IC50 | 6.889 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB771-HNC | IC50 | 8.591 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB831-BLC | IC50 | 29.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB996-RCC | IC50 | 308.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LC-1F | IC50 | 44.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LC-2-ad | IC50 | 4.977 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LC4-1 | IC50 | 7.188 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LCLC-103H cell line | IC50 | 1.427 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LCLC-97TM1 | IC50 | 1.559 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Leukocyte common antigen | IC50 | nan | None | None |
| Homo sapiens | Leukocyte common antigen | Ki | nan | None | None |
| Homo sapiens | Leukocyte elastase | IC50 | nan | None | None |
| Homo sapiens | Leukocyte elastase | Ki | nan | None | None |
| Homo sapiens | LK-2 | IC50 | 12.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LN-405 | IC50 | 245.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LNCaP-Clone-FGC | IC50 | 17.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LOUCY | IC50 | 9.689 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LoVo | IC50 | 7.902 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LOX IMVI | IC50 | 69.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LP-1 | IC50 | 311.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-1034 | IC50 | 216.18 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-123 | IC50 | 2337.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-411N | IC50 | 3.171 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-513 | IC50 | 482.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-134-A | IC50 | 47.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-139 | IC50 | 52.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-165 | IC50 | 195.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Lu-65 | IC50 | 24.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-99A | IC50 | 6.239 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LXF-289 cell line | IC50 | 4.685 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | M059J | IC50 | 14.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | M14 | IC50 | 21.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MAP kinase ERK1 | IC50 | nan | None | None |
| Homo sapiens | MAP kinase ERK1 | Ki | nan | None | None |
| Homo sapiens | MAP kinase ERK2 | IC50 | nan | None | None |
| Homo sapiens | MAP kinase ERK2 | Ki | nan | None | None |
| Homo sapiens | MAP kinase p38 alpha | IC50 | nan | None | None |
| Homo sapiens | MAP kinase p38 alpha | Ki | nan | None | None |
| Homo sapiens | Matrix metalloproteinase-1 | IC50 | nan | None | None |
| Homo sapiens | Matrix metalloproteinase-1 | Ki | nan | None | None |
| Homo sapiens | Matrix metalloproteinase 9 | IC50 | nan | None | None |
| Homo sapiens | Matrix metalloproteinase 9 | Ki | nan | None | None |
| Homo sapiens | MC116 | IC50 | 15.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MC-CAR | IC50 | 9.274 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MCF7 | GI50 | 2.4 | nM | 10.1016/j.bmcl.2008.12.077 |
| Homo sapiens | MCF7 | IC50 | 4.0 | nM | 10.1021/jm500530v |
| Homo sapiens | MCF7 | IC50 | 5.011 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MCF7 | IC50 | 70.0 | nM | 10.1021/jm900476c |
| Homo sapiens | MCF7 | IC50 | 17200.0 | nM | 10.1021/np100086x |
| Homo sapiens | MCF7 | IC50 | nan | None | 10.1016/j.ejmech.2018.04.042 |
| Homo sapiens | MC-IXC | IC50 | 1.486 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-134-VI | IC50 | 301.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-157 | IC50 | 98.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-175-VII | IC50 | 280.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-231 | IC50 | 37.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-361 | IC50 | 9.759 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-415 | IC50 | 24.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-453 | IC50 | 199.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-468 | IC50 | 7.137 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ME-180 | IC50 | 21.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MEG-01 | IC50 | 20.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Melanocortin receptor 3 | IC50 | nan | None | None |
| Homo sapiens | Melanocortin receptor 3 | Ki | nan | None | None |
| Homo sapiens | Melanocortin receptor 4 | IC50 | nan | None | None |
| Homo sapiens | Melanocortin receptor 4 | Ki | nan | None | None |
| Homo sapiens | Melanocortin receptor 5 | IC50 | nan | None | None |
| Homo sapiens | Melanocortin receptor 5 | Ki | nan | None | None |
| Homo sapiens | MEL-HO | IC50 | 3.291 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MEL-JUSO | IC50 | 4.255 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Menin/Histone-lysine N-methyltransferase MLL | Potency | 1000.0 | nM | None |
| Homo sapiens | MES-SA | Activity | 11.8 | % | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MES-SA | Activity | 17.4 | % | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MES-SA | IC50 | 3.115 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MES-SA | IC50 | 210.0 | nM | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MES-SA/Dx5 | Activity | 0.8 | % | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MES-SA/Dx5 | Activity | 1.1 | % | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MES-SA/Dx5 | Activity | 2.3 | % | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MES-SA/Dx5 | Activity | 80.0 | % | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MES-SA/Dx5 | IC50 | 32000.0 | nM | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | MeWo | IC50 | 15.18 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFE-280 | IC50 | 144.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFE-296 | IC50 | 5.989 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFH-ino | IC50 | 5.596 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFM-223 | IC50 | 4209.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MG-63 | IC50 | 2.938 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-CALL-2 | IC50 | 241.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-ES-1 | IC50 | 3.894 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-NB-11 | IC50 | 17.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-PREB-1 | IC50 | 6.884 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MIA PaCa-2 | IC50 | 5.828 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-1 | IC50 | 11.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-28 | IC50 | 4.771 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-45 | IC50 | 2.287 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-7 | IC50 | 258.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ML-2 | IC50 | 4.323 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MLMA | IC50 | 36.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MMAC-SF | IC50 | 20.46 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MN-60 | IC50 | 167.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Mo | IC50 | 2602.4 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MOLT-16 | IC50 | 12.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MOLT-4 | IC50 | 6.659 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Monoamine oxidase A | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Monoamine oxidase A | IC50 | nan | None | None |
| Homo sapiens | Monoamine oxidase A | Ki | nan | None | None |
| Homo sapiens | MONO-MAC-6 | IC50 | 20.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Mothers against decapentaplegic homolog 3 | Potency | 707.9 | nM | None |
| Homo sapiens | MPP-89 | IC50 | 342.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MRK-nu-1 | IC50 | 4.474 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MS-1 | IC50 | 79.96 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MSTO-211H | IC50 | 8800.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Mu opioid receptor | AC50 | 6755.1 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Mu opioid receptor | IC50 | nan | None | None |
| Homo sapiens | Mu opioid receptor | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M1 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Muscarinic acetylcholine receptor M1 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M1 | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M2 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Muscarinic acetylcholine receptor M2 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M2 | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M3 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M3 | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M4 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M4 | Ki | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M5 | IC50 | nan | None | None |
| Homo sapiens | Muscarinic acetylcholine receptor M5 | Ki | nan | None | None |
| Homo sapiens | MV4-11 | IC50 | 10.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MZ1-PC | IC50 | 17.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MZ2-MEL | IC50 | 42.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MZ7-mel | IC50 | 10.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NALM-6 | IC50 | 5.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB1 | IC50 | 26.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB10 | IC50 | 114.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB12 | IC50 | 2.111 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB13 | IC50 | 5.014 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB5 | IC50 | 75.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB6 | IC50 | 125.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB69 | IC50 | 45.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCCIT | IC50 | 5.419 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI/ADR-RES | IC50 | 5000.0 | nM | 10.1016/j.ejmech.2018.04.042 |
| Homo sapiens | NCI/ADR-RES | IC50 | 5000.0 | nM | 10.1021/jm3013097 |
| Homo sapiens | NCI/ADR-RES | IC50 | 5000.0 | nM | 10.1021/jm500561a |
| Homo sapiens | NCI-H1092 | IC50 | 58.07 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1155 | IC50 | 9630.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1299 | IC50 | 13.63 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1299 | IC50 | 230.0 | nM | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | NCI-H1304 | IC50 | 35.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1355 | IC50 | 2.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1395 | IC50 | 53.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1417 | IC50 | 24.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1436 | IC50 | 13.58 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1437 | IC50 | 7.111 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1522 | IC50 | 185.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1563 | IC50 | 12.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1581 | IC50 | 37.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1618 | IC50 | 714.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1623 | IC50 | 28.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1648 | IC50 | 3.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1650 | IC50 | 40.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1651 | IC50 | 60.64 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1693 | IC50 | 7895.71 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1694 | IC50 | 44.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1703 | IC50 | 2.834 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1734 | IC50 | 14.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1755 | IC50 | 17.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1770 | IC50 | 5.534 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1792 | IC50 | 95.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1793 | IC50 | 19.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1838 | IC50 | 12234.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H187 | IC50 | 14.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1882 | IC50 | 36.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1963 | IC50 | 30.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1975 | Activity | 17.39 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | Activity | 34.31 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | Activity | 51.85 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | Activity | nan | None | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | IC50 | 8.0 | nM | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | Inhibition | 0.7 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | Inhibition | 52.61 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | Inhibition | 70.48 | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1975 | Inhibition | nan | % | 10.1016/j.ejmech.2020.112332 |
| Homo sapiens | NCI-H1993 | IC50 | 740.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2009 | IC50 | 8.458 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2030 | IC50 | 3.618 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2052 | IC50 | 60.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2081 | IC50 | 33.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2087 | IC50 | 8.218 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H209 | IC50 | 50.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2122 | IC50 | 2.588 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2126 | IC50 | 29.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2141 | IC50 | 38.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2170 | IC50 | 11.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2171 | IC50 | 109.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2196 | IC50 | 328.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2227 | IC50 | 1181.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2228 | IC50 | 12.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H226 | IC50 | 24.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H23 | IC50 | 60.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2342 | IC50 | 4.785 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2347 | IC50 | 26.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2405 | IC50 | 50.71 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2452 | IC50 | 2017.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H28 | IC50 | 78.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H292 | IC50 | 5.053 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H322M | IC50 | 6407.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H345 | IC50 | 44.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H358 | IC50 | 5.888 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H441 | IC50 | 33.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H446 | IC50 | 14.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H460 | IC50 | 6.983 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H460 | IC50 | 43.7 | nM | 10.1021/jm101388d |
| Homo sapiens | NCI-H510A | IC50 | 15.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H520 | IC50 | 1.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H522 | IC50 | 0.5354 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H524 | IC50 | 69.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H526 | IC50 | 8.675 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H596 | IC50 | 659.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H630 | IC50 | 45.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H64 | IC50 | 7.273 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H650 | IC50 | 16.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H661 | IC50 | 20.35 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H661 | IC50 | 120.0 | nM | 10.1016/j.ejmech.2021.113169 |
| Homo sapiens | NCI-H69 | IC50 | 6.345 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H716 | IC50 | 4378.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H719 | IC50 | 5903.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H720 | IC50 | 10954.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H727 | IC50 | 224.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H747 | IC50 | 67.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H748 | IC50 | 56.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H810 | IC50 | 3.908 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H82 | IC50 | 60.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H838 | IC50 | 16.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H889 | IC50 | 40.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-N87 | IC50 | 44.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NEC8 | IC50 | 13.91 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Neurokinin 1 receptor | IC50 | nan | None | None |
| Homo sapiens | Neurokinin 1 receptor | Ki | nan | None | None |
| Homo sapiens | Neurokinin 2 receptor | IC50 | 1606.2 | nM | None |
| Homo sapiens | Neurokinin 2 receptor | Ki | 535.55 | nM | None |
| Homo sapiens | Neuropeptide Y receptor type 1 | IC50 | nan | None | None |
| Homo sapiens | Neuropeptide Y receptor type 1 | Ki | nan | None | None |
| Homo sapiens | Neuropeptide Y receptor type 2 | IC50 | nan | None | None |
| Homo sapiens | Neuropeptide Y receptor type 2 | Ki | nan | None | None |
| Homo sapiens | NH-12 | IC50 | 27.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NKM-1 | IC50 | 4.972 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NMC-G1 | IC50 | 14.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | no-10 | IC50 | 45.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | no-11 | IC50 | 163.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NOMO-1 | IC50 | 19.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Norepinephrine transporter | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Norepinephrine transporter | IC50 | nan | None | None |
| Homo sapiens | Norepinephrine transporter | Ki | nan | None | None |
| Homo sapiens | NOS-1 | IC50 | 41.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NTERA-2-cl-D1 | IC50 | 0.9386 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NUGC-3 | IC50 | 5.992 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NY | IC50 | 8.123 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OAW-28 | IC50 | 15.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OAW-42 | IC50 | 42.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OCI-AML2 | IC50 | 10.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OCUB-M | IC50 | 4.433 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OE19 | IC50 | 13.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OE33 | IC50 | 20.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OMC-1 | IC50 | 1264.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ONS-76 | IC50 | 3.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OPM-2 | IC50 | 6.273 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OS-RC-2 | IC50 | 34.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-3 | IC50 | 6.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-4 | IC50 | 1.745 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-5 | IC50 | 110.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-8 | IC50 | 6.601 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-8 | IC50 | 300.0 | nM | 10.1016/j.ejmech.2018.04.042 |
| Homo sapiens | OVCAR-8 | IC50 | 300.0 | nM | 10.1021/acs.jmedchem.5b00310 |
| Homo sapiens | OVCAR-8 | IC50 | 300.0 | nM | 10.1021/jm2012886 |
| Homo sapiens | OVCAR-8 | IC50 | 300.0 | nM | 10.1021/jm3013097 |
| Homo sapiens | P12-Ichikawa | IC50 | 25.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | P30-OHK | IC50 | 10.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | P31-FUJ | IC50 | 11385.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PA-1 | IC50 | 3.123 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PANC-03-27 | IC50 | 5.948 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PANC-08-13 | IC50 | 46.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Panc1005 | IC50 | 3.525 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PC-14 | IC50 | 3.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PC-3 | IC50 | 104.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PF-382 | IC50 | 11.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PFSK-1 | IC50 | 20.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | P-glycoprotein 1 | Activity | nan | None | None |
| Homo sapiens | P-glycoprotein 1 | % maximum response | 6.24 | % | None |
| Homo sapiens | P-glycoprotein 1 | Papp | 2.52 | nm/s | None |
| Homo sapiens | P-glycoprotein 1 | Papp | 176.0 | nm/s | None |
| Homo sapiens | P-glycoprotein 1 | Ratio_ATPase activity | 1.15 | None | None |
| Homo sapiens | P-glycoprotein 1 | Ratio_Papp | 69.8 | None | None |
| Homo sapiens | Phosphodiesterase 3A | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Phosphodiesterase 4A | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Phosphodiesterase 5A | IC50 | nan | None | None |
| Homo sapiens | Phosphodiesterase 5A | Ki | nan | None | None |
| Homo sapiens | Platelet activating factor receptor | IC50 | nan | None | None |
| Homo sapiens | Platelet activating factor receptor | Ki | nan | None | None |
| Homo sapiens | PLC-PRF-5 | IC50 | 101.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Progesterone receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Protein kinase C alpha | IC50 | nan | None | None |
| Homo sapiens | Protein kinase C alpha | Ki | nan | None | None |
| Homo sapiens | PSN1 | IC50 | 4444.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | QIMR-WIL | IC50 | 3.043 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Raji | IC50 | 81.64 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Ramos-2G6-4C10 | IC50 | 4.452 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RCC10RGB | IC50 | 3296.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RCM-1 | IC50 | 747.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RD | IC50 | 5.425 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Receptor protein-tyrosine kinase erbB-2 | IC50 | nan | None | None |
| Homo sapiens | Receptor protein-tyrosine kinase erbB-2 | Ki | nan | None | None |
| Homo sapiens | REH | IC50 | 7.207 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RERF-LC-MS | IC50 | 10.18 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RH-1 | IC50 | 11.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RKO | IC50 | 1.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RL | IC50 | 415.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RL95-2 | IC50 | 7.132 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RMG-I | IC50 | 93.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RO82-W-1 | IC50 | 1371.01 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-2650 | IC50 | 9.996 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-6666 | IC50 | 6.862 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-7951 | IC50 | 8.815 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-8226 | IC50 | 17.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI 8402 | IC50 | 12.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-8866 | IC50 | 6.997 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RS4-11 | IC50 | 7.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RT-112 | IC50 | 3.371 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RT-4 | IC50 | 330.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RVH-421 | IC50 | 3.881 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RXF 393 | IC50 | 5.065 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | S-117 | IC50 | 368.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SAOS-2 | IC50 | 1173.63 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SAS | IC50 | 4391.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SBC-1 | IC50 | 2564.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SBC-5 | IC50 | 2.082 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-15 | IC50 | 8.695 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-25 | IC50 | 12.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-3 | IC50 | 1753.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-4 | IC50 | 2.585 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-9 | IC50 | 2.046 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCH | IC50 | 3188.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCLC-21H | IC50 | 908.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform | IC50 | nan | None | None |
| Homo sapiens | Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform | Ki | nan | None | None |
| Homo sapiens | Serotonin 1a (5-HT1a) receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Serotonin 2a (5-HT2a) receptor | IC50 | nan | None | None |
| Homo sapiens | Serotonin 2a (5-HT2a) receptor | Ki | nan | None | None |
| Homo sapiens | Serotonin 2b (5-HT2b) receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Serotonin 2b (5-HT2b) receptor | IC50 | nan | None | None |
| Homo sapiens | Serotonin 2b (5-HT2b) receptor | Ki | nan | None | None |
| Homo sapiens | Serotonin 2c (5-HT2c) receptor | IC50 | nan | None | None |
| Homo sapiens | Serotonin 2c (5-HT2c) receptor | Ki | nan | None | None |
| Homo sapiens | Serotonin 6 (5-HT6) receptor | IC50 | nan | None | None |
| Homo sapiens | Serotonin 6 (5-HT6) receptor | Ki | nan | None | None |
| Homo sapiens | Serotonin transporter | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Serotonin transporter | IC50 | nan | None | None |
| Homo sapiens | Serotonin transporter | Ki | nan | None | None |
| Homo sapiens | SF-126 | IC50 | 459.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SF-268 | IC50 | 16.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SF-295 | IC50 | 12.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SF-539 | IC50 | 14.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SH-4 | IC50 | 15.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SHP77 | IC50 | 508.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SIG-M5 | IC50 | 2.476 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Sigma opioid receptor | IC50 | nan | None | None |
| Homo sapiens | Sigma opioid receptor | Ki | nan | None | None |
| Homo sapiens | SiHa | IC50 | 281.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SIMA | IC50 | 112.96 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SJRH30 | IC50 | 29.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SJSA-1 | IC50 | 12.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-CO-1 | IC50 | 8.497 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SKG-IIIa | IC50 | 155.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-HEP1 | IC50 | 4.517 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-LMS-1 | IC50 | 1.461 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-LU-1 | IC50 | 51.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-1 | IC50 | 1518.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-2 | IC50 | 7.183 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-24 | IC50 | 1767.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-28 | IC50 | 615.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL3 | IC50 | 17.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-30 | IC50 | 12.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MES-1 | IC50 | 5.725 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MM-2 | IC50 | 1349.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-N-AS | IC50 | 867.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-N-DZ | IC50 | 249.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-NEP-1 | IC50 | 8.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-N-FI | IC50 | 3727.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-OV-3 | IC50 | 8.386 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-OV-3 | IC50 | 26.7 | nM | 10.1021/jm101388d |
| Homo sapiens | SK-PN-DW | IC50 | 12.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-UT-1 | IC50 | 2.234 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SMMC-7721 | IC50 | 4700.0 | nM | 10.1021/np100086x |
| Homo sapiens | SN12C | IC50 | 33.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNB-75 | IC50 | 12.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNG-M | IC50 | 3.883 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU1 | IC50 | 32.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-16 | IC50 | 38.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-387 | IC50 | 10.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-423 | IC50 | 5.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-449 | IC50 | 173.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-475 | IC50 | 114.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-5 | IC50 | 45.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-C1 | IC50 | 97.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-C2B | IC50 | 7.749 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SR | IC50 | 5.842 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ST486 | IC50 | 2.957 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SU-DHL-1 | IC50 | 9.451 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SUP-T1 | IC50 | 4.719 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1088 | IC50 | 79.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW13 | IC50 | 4.717 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1417 | IC50 | 173.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1463 | IC50 | 409.46 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1573 | IC50 | 34.0 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1710 | IC50 | 2.334 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1783 | IC50 | 492.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1990 | IC50 | 73.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW48 | IC50 | 5.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW480 | IC50 | 40000.0 | nM | 10.1021/np100086x |
| Homo sapiens | SW-620 | IC50 | 8.523 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW626 | IC50 | 37.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW684 | IC50 | 24.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW756 | IC50 | 148.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW780 | IC50 | 14.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW837 | IC50 | 379.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW872 | IC50 | 5.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW948 | IC50 | 19.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW 954 | IC50 | 5.983 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW 962 | IC50 | 27.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW982 | IC50 | 5.298 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T-24 | IC50 | 284.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T47D | IC50 | 400.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T84 | IC50 | 53.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T98G | IC50 | 18.91 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TALL-1 | IC50 | 11871.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TCC-SUP | IC50 | 27.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-1 | IC50 | 13.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-10 | IC50 | 3.625 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-11 | IC50 | 9.155 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-12 | IC50 | 496.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-15 | IC50 | 3.103 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-441-T | IC50 | 34.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-5 | IC50 | 11.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-6 | IC50 | 87.2 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-8 | IC50 | 45.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-9 | IC50 | 1.078 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TGBC1TKB | IC50 | 69.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TGBC24TKB | IC50 | 20.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TGW | IC50 | 78.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | THP-1 | IC50 | 124.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Thrombin | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Thromboxane A2 receptor | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Thromboxane-A synthase | IC50 | nan | None | None |
| Homo sapiens | Thromboxane-A synthase | Ki | nan | None | None |
| Homo sapiens | TK-10 | IC50 | 116.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TT | IC50 | 2270.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Tubulin | IC50 | 700.0 | nM | 10.1016/j.bmcl.2015.02.045 |
| Homo sapiens | Tubulin | IC50 | 2000.0 | nM | 10.1021/acs.jmedchem.5b00910 |
| Homo sapiens | Tubulin | Inhibition | nan | % | 10.1016/j.ejmech.2015.03.005 |
| Homo sapiens | Tubulin | Inhibition | nan | % | 10.1021/acs.jmedchem.6b00777 |
| Homo sapiens | TUR | IC50 | 7.198 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TYK-nu | IC50 | 111.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Tyrosine-protein kinase FYN | IC50 | nan | None | None |
| Homo sapiens | Tyrosine-protein kinase FYN | Ki | nan | None | None |
| Homo sapiens | Tyrosine-protein kinase LCK | IC50 | nan | None | None |
| Homo sapiens | Tyrosine-protein kinase LCK | Ki | nan | None | None |
| Homo sapiens | Tyrosyl-DNA phosphodiesterase 1 | Potency | 141.3 | nM | None |
| Homo sapiens | Tyrosyl-DNA phosphodiesterase 1 | Potency | 12589.3 | nM | None |
| Homo sapiens | U-118-MG | IC50 | 120.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-251 | IC50 | 6.887 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-266 | IC50 | 17.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U2OS | Activity | nan | None | 10.1016/j.ejmech.2015.03.005 |
| Homo sapiens | U2OS | IC50 | 6302.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-698-M | IC50 | 12.17 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-87 MG | IC50 | 27.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-257 | IC50 | 30.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-62 | IC50 | 33.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-812 | IC50 | 8913.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-893 | IC50 | 1092.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UMC-11 | IC50 | 77.01 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UMUC3 | IC50 | 21.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UO-31 | IC50 | 1557.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | VA-ES-BJ | IC50 | 4.233 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Vascular endothelial growth factor receptor 1 | IC50 | nan | None | None |
| Homo sapiens | Vascular endothelial growth factor receptor 1 | Ki | nan | None | None |
| Homo sapiens | Vascular endothelial growth factor receptor 2 | AC50 | 30000.0 | nM | 10.1038/s41467-023-40064-9 |
| Homo sapiens | Vasoactive intestinal polypeptide receptor 1 | IC50 | nan | None | None |
| Homo sapiens | Vasoactive intestinal polypeptide receptor 1 | Ki | nan | None | None |
| Homo sapiens | Vasopressin V1a receptor | IC50 | nan | None | None |
| Homo sapiens | Vasopressin V1a receptor | Ki | nan | None | None |
| Homo sapiens | Vitamin D receptor | Potency | 44668.4 | nM | None |
| Homo sapiens | VM-CUB-1 | IC50 | 19.07 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | VMRC-RCZ | IC50 | 18.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | WM-115 | IC50 | 108.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | WSU-NHL | IC50 | 33.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | YAPC | IC50 | 1288.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | YKG-1 | IC50 | 3.73 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | YT | IC50 | 218.54 | nM | 10.6019/CHEMBL1201861 |
| Leishmania amazonensis | Leishmania amazonensis | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Leishmania donovani | Leishmania donovani | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Leishmania infantum | Leishmania infantum | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Leishmania major | Leishmania major | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Leishmania mexicana | Leishmania mexicana | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Mus musculus | CCRF S-180 | Activity | nan | None | 10.1021/np900157t |
| Mus musculus | CCRF S-180 | Inhibition | 69.4 | % | 10.1021/np900157t |
| Mus musculus | L1210 | IC50 | 65.0 | nM | 10.1021/jm3014376 |
| Mus musculus | Monoamine oxidase A | Activity | nan | None | 10.1021/jm800656v |
| Mus musculus | Monoamine oxidase B | Activity | nan | None | 10.1021/jm800656v |
| Mus musculus | Mus musculus | Activity | 10.0 | % | 10.1016/j.bmcl.2008.12.077 |
| Mus musculus | Mus musculus | Activity | 16.4 | g | 10.1016/j.bmc.2007.05.045 |
| Mus musculus | Mus musculus | Activity | 26.22 | g | 10.1016/j.bmcl.2012.10.024 |
| Mus musculus | Mus musculus | Activity | nan | None | 10.1016/j.bmcl.2012.10.024 |
| Mus musculus | Nitric oxide synthase, inducible | IC50 | nan | None | None |
| Mus musculus | Nitric oxide synthase, inducible | Ki | nan | None | None |
| Mus musculus | P388 | T/C | 114.0 | % | 10.1016/j.bmcl.2008.12.077 |
| Mus musculus | P388 | T/C | 117.0 | % | 10.1016/j.bmcl.2008.12.077 |
| Oryctolagus cuniculus | Angiotensin-converting enzyme | IC50 | nan | None | None |
| Oryctolagus cuniculus | Angiotensin-converting enzyme | Ki | nan | None | None |
| Oryctolagus cuniculus | Arachidonate 15-lipoxygenase | IC50 | nan | None | None |
| Oryctolagus cuniculus | Arachidonate 15-lipoxygenase | Ki | nan | None | None |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Pneumocystis carinii | Pneumocystis carinii | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Rattus norvegicus | Aldose reductase | IC50 | nan | None | None |
| Rattus norvegicus | Aldose reductase | Ki | nan | None | None |
| Rattus norvegicus | Alpha-1a adrenergic receptor | IC50 | nan | None | None |
| Rattus norvegicus | Alpha-1a adrenergic receptor | Ki | nan | None | None |
| Rattus norvegicus | Alpha-1b adrenergic receptor | IC50 | nan | None | None |
| Rattus norvegicus | Alpha-1b adrenergic receptor | Ki | nan | None | None |
| Rattus norvegicus | Androgen Receptor | IC50 | nan | None | None |
| Rattus norvegicus | Androgen Receptor | Ki | nan | None | None |
| Rattus norvegicus | Glycine receptor | IC50 | nan | None | None |
| Rattus norvegicus | Glycine receptor | Ki | nan | None | None |
| Rattus norvegicus | Insulin receptor | IC50 | nan | None | None |
| Rattus norvegicus | Insulin receptor | Ki | nan | None | None |
| Rattus norvegicus | Nitric-oxide synthase, brain | IC50 | nan | None | None |
| Rattus norvegicus | Nitric-oxide synthase, brain | Ki | nan | None | None |
| Rattus norvegicus | Rattus norvegicus | ALB | 42300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 42700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 43300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 44700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALB | 45300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 357.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 359.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 367.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 400.83 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 404.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALP | 436.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 44.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 45.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 48.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 49.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 58.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | ALT | 59.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 77.5 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 84.83 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 85.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 88.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 137.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | AST | 138.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BASO | 0.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BASOLE | 0.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 1.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 1.8 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 2.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BILI | 2.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 150.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 155.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 163.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 166.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 173.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | BUN | 206.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 99.5 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 99.67 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 100.0 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 100.67 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 101.0 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHLORIDE | 103.0 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 636.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 653.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 666.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 686.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 726.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CHOL | 750.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 193.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 237.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 245.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 275.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 331.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CK | 671.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 24000000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 27000000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 27330000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 29330000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CO2 | 31330000.0 | nM | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 1.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 1.8 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 1.9 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 2.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | CREAT | 2.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 0.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 15.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 48.83 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 49.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOS | 49.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOSLE | 0.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOSLE | 0.17 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | EOSLE | 0.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1436.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1638.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1663.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1673.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | GLUC | 1856.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 31.93 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 33.27 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 34.63 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 36.1 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 36.7 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HCT | 37.77 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 129300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 133000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 136000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 141300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 144200.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | HGB | 149700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 98.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 125.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 152.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 160.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 308.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LDH | 320.17 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 9.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 9.17 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 9.33 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 9.67 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LIPASE | 10.0 | U.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 5207.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 6817.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 9513.5 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 13595.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 14282.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYM | 14562.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 84.67 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 87.67 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 88.83 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 92.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 95.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | LYMLE | 99.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 23.67 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 24.17 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 24.47 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 24.52 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 25.3 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCH | 25.4 | pg | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 392000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 392800.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 393000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 396300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 400000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCHC | 405000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 58.4 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 61.57 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 62.37 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 62.5 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 63.43 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MCV | 63.93 | fL | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 23.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 24.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 49.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 94.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 138.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONO | 462.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 0.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 0.67 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 0.83 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | MONOLE | 3.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 0.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 4.33 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 7.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 9.0 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 10.17 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTLE | 14.67 | % | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 24.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 236.33 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 709.83 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 1292.67 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 1733.83 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | NEUTSG | 2420.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 106.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 120.5 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 121.2 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 124.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 130.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PHOS | 137.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 359000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 808330.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 903170.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1076500.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1168330.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PLAT | 1301000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 5.92 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 6.34 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 6.54 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 6.68 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 6.88 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | POTASSIUM | 7.02 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 58700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 61300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 62000.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 62300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 62700.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | PROT | 63300.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5250000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5470000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5630000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5780000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5890000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBC | 5910000.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBCNUC | 0.0 | /100WBC | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | RBCNUC | 0.33 | /100WBC | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 143.02 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 144.02 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 145.07 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 145.37 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 146.0 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | SODIUM | 146.4 | mEq.L-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | Tissue Severity Score | nan | None | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 9.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 16.3 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 20.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 21.0 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | URATE | 23.7 | ug.mL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 5470.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 6870.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 10330.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 15400.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 16480.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Rattus norvegicus | WBC | 16800.0 | cells.uL-1 | 10.6019/CHEMBL3885881 |
| Rattus norvegicus | Serotonin 1a (5-HT1a) receptor | IC50 | nan | None | None |
| Rattus norvegicus | Serotonin 1a (5-HT1a) receptor | Ki | nan | None | None |
| Rattus norvegicus | Serotonin 1b (5-HT1b) receptor | IC50 | nan | None | None |
| Rattus norvegicus | Serotonin 1b (5-HT1b) receptor | Ki | nan | None | None |
| Rattus norvegicus | Thioredoxin reductase 1, cytoplasmic | Potency | 28183.8 | nM | None |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 19952.62 | nM | 10.6019/CHEMBL4651402 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 20000.0 | nM | 10.6019/CHEMBL4651402 |
| Sus scrofa | Tubulin | Activity | nan | None | 10.1021/jm101388d |
| Sus scrofa | Tubulin | Inhibition | nan | % | 10.1021/acs.jmedchem.6b00777 |
| Sus scrofa | Tubulin | Ratio | 1.19 | None | 10.1016/j.bmc.2008.04.025 |
| Toxoplasma gondii | Toxoplasma gondii | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Trichomonas vaginalis | Trichomonas vaginalis | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Trypanosoma brucei | Trypanosoma brucei | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Trypanosoma brucei brucei | Trypanosoma brucei brucei | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| Trypanosoma cruzi | Trypanosoma cruzi | EC50 | 10000.0 | nM | 10.1128/aac.01777-09 |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| None | ADMET | CL | 12.0 | mL.min-1.kg-1 | 10.1124/dmd.108.020479 |
| None | ADMET | CL | 20.0 | mL.min-1.kg-1 | 10.1124/dmd.105.006619 |
| None | ADMET | CL | 20.0 | mL.min-1.kg-1 | 10.1124/dmd.108.020479 |
| None | ADMET | CL | 21.0 | mL.min-1.kg-1 | 10.1124/dmd.105.006619 |
| None | ADMET | CL | 23.6 | mL.min-1.kg-1 | 10.1124/dmd.105.006619 |
| None | ADMET | CL | 31.7 | mL.min-1.kg-1 | 10.1124/dmd.105.006619 |
| None | ADMET | EC50 | 50000.0 | nM | 10.1128/aac.01777-09 |
| None | ADMET | MRT | 17.0 | hr | 10.1124/dmd.108.020479 |
| None | ADMET | MRT | 18.0 | hr | 10.1124/dmd.108.020479 |
| None | ADMET | Papp | 1.4 | ucm/s | 10.1124/dmd.110.034629 |
| None | ADMET | Papp | 3.0 | ucm/s | 10.1124/dmd.110.034629 |
| None | ADMET | Papp | 8.5 | ucm/s | 10.1124/dmd.110.034629 |
| None | ADMET | Ratio | 1.0 | None | 10.1124/dmd.110.034629 |
| None | ADMET | Ratio | 5.9 | None | 10.1124/dmd.110.034629 |
| None | ADMET | Ratio | 65.0 | None | 10.1124/dmd.110.034629 |
| None | ADMET | Ratio | 83.0 | None | 10.1124/dmd.110.034629 |
| None | ADMET | Ratio | 108.0 | None | 10.1124/dmd.110.034629 |
| None | ADMET | T1/2 | 18.0 | hr | 10.1124/dmd.108.020479 |
| None | ADMET | T1/2 | 26.0 | hr | 10.1124/dmd.108.020479 |
| None | ADMET | Vdss | 11.4 | L.kg-1 | 10.1124/dmd.105.006619 |
| None | ADMET | Vdss | 12.0 | L.kg-1 | 10.1124/dmd.108.020479 |
| None | ADMET | Vdss | 23.0 | L.kg-1 | 10.1124/dmd.108.020479 |
| None | ADMET | Vdss | 24.4 | mL/min/kg | 10.1124/dmd.105.006619 |
| None | ADMET | Vdss | 49.6 | L.kg-1 | 10.1124/dmd.105.006619 |
| None | ADMET | Vdss | 75.6 | L.kg-1 | 10.1124/dmd.105.006619 |
| None | BC1 cell line | IC50 | 9.391 | nM | 10.6019/CHEMBL1201861 |
| None | Hepatotoxicity | Alkaline Phosphatase Increase - Activity Score | nan | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | Alkaline Phosphatase Increase - Index Value | 2.8 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | Alkaline Phosphatase Increase - Number of Reports | 4.0 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | Composite Activity - Active | 1.0 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | Composite Activity - Marginal | 0.0 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | Composite Activity - Score | nan | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | GGT Increase - Activity Score | nan | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | GGT Increase - Index Value | 0.9 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | GGT Increase - Number of Reports | 4.0 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | Hepatotoxicity | nan | None | 10.1021/tx900326k |
| None | Hepatotoxicity | HepSE_bilirubinemia | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_cholecystitis | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_cholelithiasis | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_cirrhosis | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_Combined Scores | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_elevated liver function tests | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_hepatic failure | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_hepatic necrosis | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_hepatitis | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_hepatomegaly | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_jaundice | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_liver disease | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_liver fatty | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | HepSE_liver function tests abnormal | 0.0 | None | 10.1371/journal.pcbi.1002310 |
| None | Hepatotoxicity | LDH Increase - Activity Score | nan | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | LDH Increase - Index Value | 4.7 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | LDH Increase - Number of Reports | 4.0 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | SGOT Increase - Activity Score | nan | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | SGOT Increase - Index Value | 0.9 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | SGOT Increase - Number of Reports | 4.0 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | SGPT Increase - Activity Score | nan | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | SGPT Increase - Index Value | 1.9 | None | 10.2174/1570163043334794 |
| None | Hepatotoxicity | SGPT Increase - Number of Reports | 4.0 | None | 10.2174/1570163043334794 |
| None | NON-PROTEIN TARGET | Activity | 35.0 | % | 10.1016/j.ejmech.2016.09.013 |
| None | NON-PROTEIN TARGET | Activity | nan | None | 10.1016/j.ejmech.2016.09.013 |
| None | NON-PROTEIN TARGET | Activity | nan | None | 10.1021/acs.jmedchem.6b00525 |
| None | NON-PROTEIN TARGET | Fu | 0.87 | None | 10.1124/dmd.108.020479 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (acute) | 6.0 | % | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (animal toxicity known) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (benign tumour) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (granulomatous hepatitis) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (mechanism) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (moderate) | 6.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (moderate) | 24.1 | % | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (time to onset) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | IC50 | 0.07 | nM | 10.1016/j.bmcl.2015.03.081 |
| None | NON-PROTEIN TARGET | IC50 | 2.0 | nM | 10.1021/jm4004347 |
| None | NON-PROTEIN TARGET | IC50 | 2.0 | nM | 10.1021/jm500530v |
| None | NON-PROTEIN TARGET | IC50 | 3.0 | nM | 10.1021/acs.jmedchem.6b00525 |
| None | NON-PROTEIN TARGET | IC50 | 3.5 | nM | 10.1016/j.bmcl.2015.02.045 |
| None | NON-PROTEIN TARGET | IC50 | 15.0 | nM | 10.1016/j.bmcl.2015.02.045 |
| None | NON-PROTEIN TARGET | IC50 | 15.0 | nM | 10.1021/np500170v |
| None | NON-PROTEIN TARGET | IC50 | 300.0 | nM | 10.1021/jm500561a |
| None | NON-PROTEIN TARGET | IC50 | 410.0 | nM | 10.1021/acs.jmedchem.6b00525 |
| None | NON-PROTEIN TARGET | IC50 | 5000.0 | nM | 10.1021/acs.jmedchem.5b00310 |
| None | NON-PROTEIN TARGET | IC50 | 5000.0 | nM | 10.1021/jm2012886 |
| None | NON-PROTEIN TARGET | IC50 | nan | None | 10.1016/j.bmc.2010.01.068 |
| None | NON-PROTEIN TARGET | IC50 | nan | None | 10.1021/jm3013097 |
| None | NON-PROTEIN TARGET | Ratio IC50 | 137.0 | None | 10.1021/acs.jmedchem.6b00525 |
| None | No relevant target | LogP | 4.0 | None | 10.1016/j.ejmech.2009.12.043 |
| None | Unchecked | Activity | 30.0 | % | 10.1021/acs.jmedchem.6b00777 |
| None | Unchecked | Activity | nan | None | 10.1021/acs.jmedchem.6b00777 |
| None | Unchecked | Flu intensity | 0.42 | None | 10.1021/acs.jmedchem.6b00525 |
| None | Unchecked | Flu intensity | 1.6 | None | 10.1021/acs.jmedchem.6b00525 |
| None | Unchecked | Hepatotoxicity (acute) | 3.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (association with vascular disease) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (choleostasis) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (chronic liver disease) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (cirrhosis) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (comment) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (cytolytic) | 2.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (malignant tumour) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (severe hepatitis) | 1.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (steatosis) | 0.0 | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | Hepatotoxicity (successful reintroduction) | nan | None | 10.1016/s0399-8320(04)95062-2 |
| None | Unchecked | IC50 | 66.0 | nM | 10.1021/acs.jmedchem.8b00035 |
| None | Unchecked | IC50 | 600.0 | nM | 10.1021/jm500530v |
| None | Unchecked | IC50 | 700.0 | nM | 10.1021/jm4004347 |
| None | Unchecked | IC50 | 5202.0 | nM | None |
| None | Unchecked | IC50 | nan | None | None |
| None | Unchecked | Inhibition | nan | % | 10.1016/j.ejmech.2016.09.013 |
| None | Unchecked | Inhibition | nan | % | 10.1016/j.ejmech.2021.113169 |
| None | Unchecked | Ki | 4746.0 | nM | None |
| None | Unchecked | Ki | nan | None | None |
| None | Unchecked | Potency | 1412.5 | nM | None |
| None | Unchecked | Potency | 2511.9 | nM | None |
| None | Unchecked | Potency | 7079.5 | nM | None |
| None | Unchecked | Potency | 12589.3 | nM | None |
| None | Unchecked | Ratio | 0.9 | None | 10.1021/acs.jmedchem.6b00525 |
| None | Unchecked | Ratio EC50 | 5.0 | None | 10.1128/aac.01777-09 |
| None | Unchecked | TGI | 6.0 | nM | 10.1021/acs.jnatprod.8b01015 |
| None | Unchecked | TGI | 80.0 | nM | 10.1021/acs.jnatprod.8b01015 |