Bleomycin
AlkaPlorer ID: AK023146
Synonym: None
IUPAC Name: 3-[[2-[2-[2-[[(2S,3R)-2-[[(2S,3S,4R)-4-[[(2S,3R)-2-[[6-amino-2-[(1S)-3-amino-1-[[(2S)-2,3-diamino-3-oxopropyl]amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[(2R,3S,4S,5S,6S)-3-[(2R,3S,4S,5R,6R)-4-carbamoyloxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxy-2-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl-dimethylsulfanium
Structure
SMILES: CC1=C(C(O)=N[C@H](C(O)=N[C@H](C)[C@@H](O)[C@H](C)C(O)=N[C@H](C(O)=NCCC2=NC(C3=NC(C(O)=NCCC[S+](C)C)=CS3)=CS2)[C@@H](C)O)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](OC(=N)O)[C@@H]2O)C2=CN=CN2)N=C([C@H](CC(=N)O)NC[C@H](N)C(=N)O)NC1=N
InChI: InChI=1S/C55H83N17O21S3/c1-20-33(69-46(72-44(20)58)25(12-31(57)76)64-13-24(56)45(59)82)50(86)71-35(41(26-14-61-19-65-26)91-54-43(39(80)37(78)29(15-73)90-54)92-53-40(81)42(93-55(60)88)38(79)30(16-74)89-53)51(87)66-22(3)36(77)21(2)47(83)70-34(23(4)75)49(85)63-10-8-32-67-28(18-94-32)52-68-27(17-95-52)48(84)62-9-7-11-96(5)6/h14,17-19,21-25,29-30,34-43,53-54,64,73-75,77-81H,7-13,15-16,56H2,1-6H3,(H13-,57,58,59,60,61,62,63,65,66,69,70,71,72,76,82,83,84,85,86,87,88)/p+1/t21-,22+,23+,24-,25-,29-,30+,34-,35-,36-,37+,38+,39-,40-,41-,42-,43-,53+,54-/m0/s1
InChIKey: OYVAGSVQBOHSSS-UAPAGMARSA-O
Reference
PubChem CID: 5460769
CAS: 11056-06-7
LOTUS: LTS0059553
NPASS: NPC314774
{NPAtlas: NPA020036
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 1415.5760000000018
TPSA？: 648.2200000000001
MolLogP？: -1.6886999999999972
Number of H-Donors: 24
Number of H-Acceptors: 30
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia salina | Artemia salina | LC50 | 0.41 | ppm | 10.1016/j.ejmech.2009.05.031 |
| Artemia salina | Artemia salina | LC50 | 0.41 | ug.mL-1 | 10.1016/j.ejmech.2009.06.022 |
| Bos taurus | Calf thymus DNA | Activity | 30.0 | % | 10.1021/np50078a006 |
| Cricetulus griseus | CHO | Log CR | 0.0 | None | 10.1021/jm00169a014 |
| Drosophila melanogaster | Drosophila melanogaster | GI | nan | None | 10.1016/j.bmc.2011.09.059 |
| Electrophorus electricus | Acetylcholinesterase | Inhibition | 10.15 | % | 10.1016/j.bmc.2012.09.040 |
| Equus caballus | Cholinesterase | Inhibition | 10.78 | % | 10.1016/j.bmc.2012.09.040 |
| Homo sapiens | 23132-87 | IC50 | 131.46 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 5637 | IC50 | 28.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 639-V | IC50 | 219.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 647-V | IC50 | 1733.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 697 | IC50 | 1575.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 769-P | IC50 | 122.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 786-0 | IC50 | 80.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 8305C | IC50 | 804.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 8505C | IC50 | 1039.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | 8-MG-BA | IC50 | 1479.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A101D | IC50 | 619.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A 172 | IC50 | 39726.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A204 | IC50 | 200.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A2058 | IC50 | 807.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A253 cell line | IC50 | 2855.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A2780 | IC50 | 220.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A-375 | IC50 | 71.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A388 | IC50 | 877.18 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A3-KAW | IC50 | 716.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A-427 | IC50 | 0.118 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A-431 | IC50 | 2111.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A498 | IC50 | 1019140.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A4-Fuk | IC50 | 25288.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A673 | IC50 | 10456.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | A704 | IC50 | 10643.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ABC-1 | IC50 | 19667.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ACHN | IC50 | 374.63 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ACN | IC50 | 808.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | AGS | IC50 | 502.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ALL-PO | IC50 | 986.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | AM-38 | IC50 | 4941.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | AN3-CA | IC50 | 2550.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ARH-77 | IC50 | 104.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Aspartyl/asparaginyl beta-hydroxylase | IC50 | 1470.0 | nM | 10.1016/j.bmc.2020.115675 |
| Homo sapiens | Aspartyl/asparaginyl beta-hydroxylase | IC50 | 1650.0 | nM | 10.1016/j.bmc.2020.115675 |
| Homo sapiens | Aspartyl/asparaginyl beta-hydroxylase | IC50 | 1990.0 | nM | 10.1016/j.bmc.2020.115675 |
| Homo sapiens | Aspartyl/asparaginyl beta-hydroxylase | IC50 | 3810.0 | nM | 10.1016/j.bmc.2020.115675 |
| Homo sapiens | Aspartyl/asparaginyl beta-hydroxylase | Inhibition | 97.5 | % | 10.1016/j.bmc.2020.115675 |
| Homo sapiens | Aspartyl/asparaginyl beta-hydroxylase | Tm | -0.8 | degrees C | 10.1016/j.bmc.2020.115675 |
| Homo sapiens | ASPC1 | IC50 | 82502.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ATN-1 | IC50 | 18920.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | AU565 | IC50 | 2054.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BB30-HNC | IC50 | 16.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BB49-HNC | IC50 | 38761.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BB65-RCC | IC50 | 21426.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BC-3 | IC50 | 521.0 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BCPAP | IC50 | 1435.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BE-13 | IC50 | 398.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Becker | IC50 | 26925.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BEN | IC50 | 46043.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BFTC-905 | IC50 | 2318.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BFTC-909 | IC50 | 13.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BHT-101 | IC50 | 7340.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BHY | IC50 | 1827.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BL-41 | IC50 | 14197.46 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BL-70 | IC50 | 1650325.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Bleomycin hydrolase | FC | 0.12 | None | 10.1016/j.bmcl.2018.04.065 |
| Homo sapiens | Bleomycin hydrolase | Kcat | 4.0 | /s | 10.1016/j.bmcl.2018.04.065 |
| Homo sapiens | Bleomycin hydrolase | Kcat/Km | 0.005 | /s/microM | 10.1016/j.bmcl.2018.04.065 |
| Homo sapiens | Bleomycin hydrolase | Kcat/Km | 6.7 | 10'-3/microM/s | 10.1016/j.bmcl.2018.04.065 |
| Homo sapiens | Bleomycin hydrolase | Km | 592000.0 | nM | 10.1016/j.bmcl.2018.04.065 |
| Homo sapiens | BOKU | IC50 | 136.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BPH-1 | IC50 | 59.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BT-20 | IC50 | 2767.0 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BT-474 | IC50 | 2079456.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BV-173 | IC50 | 854.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | BXPC-3 | IC50 | 3805.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C2BBe1 | IC50 | 91801.63 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C32 | IC50 | 471476.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C-33-A | IC50 | 431.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C3A | IC50 | 296.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C-4-II | IC50 | 381.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | C8166 | IC50 | 7770.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CA46 | IC50 | 84849.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Ca9-22 | IC50 | 745.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAKI-1 | IC50 | 620.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-120 | IC50 | 5561.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-12T | IC50 | 258.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-148 | IC50 | 4601.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-27 | IC50 | 8072.96 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-33 | IC50 | 2146.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-39 | IC50 | 0.3147 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-51 | IC50 | 0.09899 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-54 | IC50 | 190.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-62 | IC50 | 3340.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-72 | IC50 | 580273.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAL-85-1 | IC50 | 0.1777 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Calu-1 | IC50 | 5137.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Calu-3 | IC50 | 6190.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Calu-6 | IC50 | 7671.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAMA-1 | IC50 | 17524.73 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Caov-3 cell line | IC50 | 20461.29 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAPAN-1 | IC50 | 2921.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Capan-2 | IC50 | 24215.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CaR-1 | IC50 | 4447.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CAS-1 | IC50 | 81029.64 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Ca-Ski | IC50 | 798.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CCF-STTG1 | IC50 | 4562.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CCRF-CEM | IC50 | 78.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CESS | IC50 | 0.5457 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CGTH-W-1 | IC50 | 4302.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ChaGo-K-1 | IC50 | 16364.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CHL-1 | IC50 | 731.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CHP-126 | IC50 | 1268.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CHP-212 | IC50 | 147.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CMK | IC50 | 14796.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO 205 | IC50 | 3244.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-320-HSR | IC50 | 3433.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-668 | IC50 | 0.02177 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-678 | IC50 | 36238.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-679 | IC50 | 2661.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-680N | IC50 | 5758.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-684 | IC50 | 237464.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-741 | IC50 | 16422.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-792 | IC50 | 26405.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-800 | IC50 | 2207.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-824 | IC50 | 53329.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COLO-829 | IC50 | 36971.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L105 | IC50 | 7365.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L23 | IC50 | 75.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L279 | IC50 | 25352.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | COR-L88 | IC50 | 73424.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CP50-MEL-B | IC50 | 3952383.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CP66-MEL | IC50 | 956929.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CPC-N | IC50 | 52489.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CTB-1 | IC50 | 26.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CTV-1 | IC50 | 4920.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CW-2 | IC50 | 564060.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | CWR22R | IC50 | 7329.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-263MG | IC50 | 142205.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D283 Med | IC50 | 3812.18 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-392MG | IC50 | 13579.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-502MG | IC50 | 1006506.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | D-542MG | IC50 | 60279.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Daoy | IC50 | 83.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Daudi | IC50 | 1670.96 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DB | IC50 | 5119.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DBTRG-05MG | IC50 | 5673.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DEL | IC50 | 479.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Detroit 562 | IC50 | 11931.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DG-75 | IC50 | 16914.17 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DJM-1 | IC50 | 1131.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DK-MG | IC50 | 85767.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-114 | IC50 | 6786.17 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-153 | IC50 | 164634.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-273 | IC50 | 2980.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-53 | IC50 | 319438.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DMS-79 | IC50 | 325259.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DOHH-2 | IC50 | 5288.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DOK | IC50 | 322399.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DoTc2-4510 | IC50 | 378.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DSH1 | IC50 | 154526.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DU-145 | IC50 | 822.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DU-4475 | IC50 | 1268.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | DV-90 | IC50 | 182133.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EB2 | IC50 | 691.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EB-3 | IC50 | 21833.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ECC4 | IC50 | 56700.73 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EC-GI-10 | IC50 | 305114.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFE-184 | IC50 | 383143.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFM-19 | IC50 | 14.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFO-21 | IC50 | 4330.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EFO-27 | IC50 | 571.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EGI-1 | IC50 | 772.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EHEB | IC50 | 1608.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EKVX | IC50 | 412980.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EM-2 | IC50 | 84752.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EOL1 | IC50 | 2415.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES1 | IC50 | 26.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES3 | IC50 | 1608.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES4 | IC50 | 38.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES5 | IC50 | 505.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES6 | IC50 | 406.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES7 | IC50 | 377.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ES8 | IC50 | 1398.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ESS-1 | IC50 | 187.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ETK-1 | IC50 | 80.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EVSA-T | IC50 | 860737.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-1 | IC50 | 1817.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-11 | IC50 | 6412.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-13 | IC50 | 292.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-16 | IC50 | 6.853 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-18 | IC50 | 75849.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-24 | IC50 | 95331.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-3 | IC50 | 18501.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | EW-7 | IC50 | 3058.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | FaDu | IC50 | 5137.73 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | FTC-133 | IC50 | 1293.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | G-361 | IC50 | 88.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | G-401 | IC50 | 3289.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | G-402 | IC50 | 76.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GAK | IC50 | 126131.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GAMG | IC50 | 289.35 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GB-1 | IC50 | 390.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GCIY | IC50 | 12754.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GCT | IC50 | 4990.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GDM-1 | IC50 | 228.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GI-1 | IC50 | 1200.01 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GI-ME-N | IC50 | 440.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GMS-10 | IC50 | 2108472.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GOTO | IC50 | 549.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GP5d | IC50 | 15635.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GR-ST | IC50 | 23097.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | GT3TKB | IC50 | 6.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | H4 | IC50 | 320.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HAL-01 | IC50 | 0.4527 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HC-1 | IC50 | 992.91 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1143 | IC50 | 27191.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1187 | IC50 | 32908.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1395 | IC50 | 500.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1419 | IC50 | 253305.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1569 | IC50 | 604.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1599 | IC50 | 3368.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1806 | IC50 | 8.543 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1937 | IC50 | 0.254 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC1954 | IC50 | 84162.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC2157 | IC50 | 93359.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC2218 | IC50 | 41889.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC 2998 | IC50 | 6.592 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC38 | IC50 | 31.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCC70 | IC50 | 125868.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCE-4 | IC50 | 453.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCE-T | IC50 | 2831.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCT-116 | IC50 | 2883.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HCT-15 | IC50 | 95.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HDLM-2 | IC50 | 14317.71 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HD-MY-Z | IC50 | 560.2 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HEC-1 | IC50 | 27362.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HEL | IC50 | 10836.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HepG2 | GI50 | 1000.0 | nM | 10.1016/j.bmcl.2007.11.092 |
| Homo sapiens | HGC-27 | IC50 | 2836.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HH | IC50 | 2286.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HL-60 | IC50 | 35284.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HLE | IC50 | 3996.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HMV-2 cell line | IC50 | 69.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HN | IC50 | 29137.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HO-1-N-1 | IC50 | 4417.81 | nM | 10.6019/CHEMBL1201861 |
| 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 | HOP-62 | IC50 | 4.134 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HOP-92 | IC50 | 9260.0 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HOS | IC50 | 560.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HPAF-II | IC50 | 232909.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Hs-578T | IC50 | 343668.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HSC-2 | IC50 | 2466.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HSC-3 | IC50 | 688.29 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HSC-4 | IC50 | 152711.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT | IC50 | 5555.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-1080 | IC50 | 233.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT1197 | IC50 | 2740.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-1376 | IC50 | 9737.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-144 | IC50 | 55.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-29 | IC50 | 535.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT-3 | IC50 | 5777.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HT55 | IC50 | 1042240.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HTC-C3 | IC50 | 77842.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuCCT-1 | IC50 | 10934.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Huh-7 | IC50 | 2434.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuO-3N1 | IC50 | 87829.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuP-T3 | IC50 | 4791.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuP-T4 | IC50 | 1312.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | HuTu80 | IC50 | 0.1358 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IA-LM | IC50 | 3401.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IGR-1 | IC50 | 2346.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IGROV-1 | IC50 | 144.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IM-9 | IC50 | 4131.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IMR-5 | IC50 | 137.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IPC-298 | IC50 | 2212.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-MEL1 | IC50 | 279.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-MES1 | IC50 | 206195.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-SL1 | IC50 | 54585.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | IST-SL2 | IC50 | 0.1732 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | J82 | IC50 | 774.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JAR | IC50 | 206497.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JEG-3 | IC50 | 8550.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JIYOYE | IC50 | 3384.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | J-RT3-T3-5 | IC50 | 712.28 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JVM-2 | IC50 | 572.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | JVM-3 | IC50 | 429308.17 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | K052 | IC50 | 482330.23 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | K5 | IC50 | 72364.58 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | K562 | IC50 | 126227.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KALS-1 | IC50 | 11742.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KARPAS-299 | IC50 | 27202.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KARPAS-422 | IC50 | 167898.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KARPAS-45 | IC50 | 212766.64 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KE-37 | IC50 | 25917.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KG-1 | IC50 | 130.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KGN | IC50 | 3.712 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KINGS-1 | IC50 | 1273587.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KLE | IC50 | 21239.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KM12 | IC50 | 9188.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KM-H2 | IC50 | 6966.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KMOE-2 | IC50 | 544232.2 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KMS-12-PE | IC50 | 2531390.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KNS-42 | IC50 | 693231.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KNS-81-FD | IC50 | 663577.73 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KOSC-2 | IC50 | 319230.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KP-4 | IC50 | 2170.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KP-N-YN | IC50 | 26336.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KP-N-YS | IC50 | 30285.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KS-1 | IC50 | 10.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KU-19-19 | IC50 | 525463.64 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KU812 cell line | IC50 | 67960.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KURAMOCHI | IC50 | 2038.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KY821 | IC50 | 470552.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-140 | IC50 | 3896.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-150 cell line | IC50 | 2.647 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-180 | IC50 | 3798.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-270 | IC50 | 716.9 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-410 | IC50 | 8146.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-450 | IC50 | 1934.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-510 | IC50 | 1857.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-520 cell line | IC50 | 6788.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | KYSE-70 cell line | IC50 | 1378.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | L-363 | IC50 | 186931.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | L-428 | IC50 | 52335.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | L-540 | IC50 | 23549.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LAMA-84 | IC50 | 4286.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LAN-6 | IC50 | 14634.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB1047-RCC | IC50 | 32.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB2241-RCC | IC50 | 738.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB2518-MEL | IC50 | 182.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB373-MEL-D | IC50 | 56407.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB647-SCLC | IC50 | 3142.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB771-HNC | IC50 | 208907.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB831-BLC | IC50 | 8382.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LB996-RCC | IC50 | 175.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LC-1F | IC50 | 49407.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LC-2-ad | IC50 | 80.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LC4-1 | IC50 | 11160.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LCLC-103H cell line | IC50 | 143.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LCLC-97TM1 | IC50 | 1495.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LK-2 | IC50 | 1689.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LN-405 | IC50 | 402376.01 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LNCaP-Clone-FGC | IC50 | 18315.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LOUCY | IC50 | 9.935 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LoVo | IC50 | 71.17 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LOX IMVI | IC50 | 452.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LP-1 | IC50 | 306523.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-1034 | IC50 | 35375.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-123 | IC50 | 23428.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-411N | IC50 | 52.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LS-513 | IC50 | 28966.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-134-A | IC50 | 41821.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-139 | IC50 | 3442292.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-165 | IC50 | 41795.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Lu-65 | IC50 | 19467.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LU-99A | IC50 | 4.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | LXF-289 cell line | IC50 | 644.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | M059J | IC50 | 3767.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | M14 | IC50 | 3224.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MC116 | IC50 | 2110.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MC-CAR | IC50 | 1399.29 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MCF7 | IC50 | 1165.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MCF7 | IC50 | 53000.0 | nM | 10.1021/jm021003k |
| Homo sapiens | MCF7 | Viable cells | 48.0 | % | 10.1021/jm021003k |
| Homo sapiens | MCF7 | Viable cells | 51.0 | % | 10.1021/jm021003k |
| Homo sapiens | MCF7 | Viable cells | 57.0 | % | 10.1021/jm021003k |
| Homo sapiens | MCF7 | Viable cells | 65.0 | % | 10.1021/jm021003k |
| Homo sapiens | MCF7 | Viable cells | 69.0 | % | 10.1021/jm021003k |
| Homo sapiens | MC-IXC | IC50 | 2996.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-134-VI | IC50 | 340261.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-157 | IC50 | 306944.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-175-VII | IC50 | 1510.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-231 | IC50 | 273.07 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-361 | IC50 | 719.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-415 | IC50 | 67333.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-453 | IC50 | 15415.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MDA-MB-468 | IC50 | 67552.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ME-180 | IC50 | 40862.8 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MEG-01 | IC50 | 395.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MEL-HO | IC50 | 850.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MEL-JUSO | IC50 | 108.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MES-SA | IC50 | 1673.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MeWo | IC50 | 147962.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFE-280 | IC50 | 359031.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFE-296 | IC50 | 153.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFH-ino | IC50 | 2.646 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MFM-223 | IC50 | 10991703.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MG-63 | IC50 | 1489.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-CALL-2 | IC50 | 534.64 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-ES-1 | IC50 | 43.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-NB-11 | IC50 | 2005.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MHH-PREB-1 | IC50 | 836201.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MIA PaCa-2 | IC50 | 110.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-1 | IC50 | 79.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-28 | IC50 | 1.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-45 | IC50 | 24.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MKN-7 | IC50 | 66529.6 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ML-2 | IC50 | 131.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MLMA | IC50 | 870.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MMAC-SF | IC50 | 21327.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MN-60 | IC50 | 4051.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Mo | IC50 | 103357.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MOLT-16 | IC50 | 29516.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MOLT-4 | IC50 | 1773.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MONO-MAC-6 | IC50 | 4593.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MPP-89 | IC50 | 39880.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MRK-nu-1 | IC50 | 1452.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MS-1 | IC50 | 156184.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MSTO-211H | IC50 | 149458.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MV4-11 | IC50 | 9.908 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MZ1-PC | IC50 | 224.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MZ2-MEL | IC50 | 2946.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | MZ7-mel | IC50 | 130.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NALM-6 | IC50 | 420.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB1 | IC50 | 11596.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB10 | IC50 | 13846.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB12 | IC50 | 82399.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB13 | IC50 | 36743.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB5 | IC50 | 6720.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB6 | IC50 | 430371.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NB69 | IC50 | 922.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCCIT | IC50 | 1068.73 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1092 | IC50 | 160052.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1155 | IC50 | 73212.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1299 | IC50 | 107.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1304 | IC50 | 4104.7 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1355 | IC50 | 8204.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1395 | IC50 | 384417.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1417 | IC50 | 30391.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1436 | IC50 | 2768516.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1437 | IC50 | 742.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1522 | IC50 | 2446914.2 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1563 | IC50 | 20606.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1573 | IC50 | 268247.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1581 | IC50 | 110223.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1618 | IC50 | 5985.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1623 | IC50 | 39047.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1648 | IC50 | 20320.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1650 | IC50 | 499.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1651 | IC50 | 505.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1693 | IC50 | 16565.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1694 | IC50 | 43882.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1703 | IC50 | 16.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1734 | IC50 | 17.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1755 | IC50 | 26001.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1770 | IC50 | 5290.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1792 | IC50 | 2566.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1793 | IC50 | 27172.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1838 | IC50 | 24523.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H187 | IC50 | 8791274.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1882 | IC50 | 11455.03 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1963 | IC50 | 192661.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H1993 | IC50 | 646262.0 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2009 | IC50 | 2564.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2030 | IC50 | 5217.63 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2052 | IC50 | 2965.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2081 | IC50 | 221405.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2087 | IC50 | 2347.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H209 | IC50 | 34316.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2122 | IC50 | 509.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2126 | IC50 | 357574.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2141 | IC50 | 36115.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2170 | IC50 | 162.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2171 | IC50 | 1419690.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2196 | IC50 | 22849.4 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2227 | IC50 | 720618.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2228 | IC50 | 954.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H226 | IC50 | 77360.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H23 | IC50 | 2466.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2342 | IC50 | 13.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2347 | IC50 | 5116.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2405 | IC50 | 4277.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H2452 | IC50 | 2138412.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H28 | IC50 | 2738.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H292 | IC50 | 803.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H322M | IC50 | 7318839.09 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H345 | IC50 | 813915.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H358 | IC50 | 372.71 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H441 | IC50 | 9049.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H446 | IC50 | 18881.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H460 | IC50 | 4755.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H510A | IC50 | 1091.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H520 | IC50 | 16052.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H522 | IC50 | 425.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H524 | IC50 | 189995.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H526 | IC50 | 1279.96 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H596 | IC50 | 13575.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H64 | IC50 | 641.01 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H650 | IC50 | 0.5873 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H661 | IC50 | 2787.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H69 | IC50 | 103909.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H716 | IC50 | 1421117.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H719 | IC50 | 293028.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H720 | IC50 | 103351.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H727 | IC50 | 10310.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H747 | IC50 | 1213.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H748 | IC50 | 75176.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H810 | IC50 | 55127.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H82 | IC50 | 225453.74 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H838 | IC50 | 5947.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-H889 | IC50 | 512577.54 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NCI-N87 | IC50 | 2964.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NEC8 | IC50 | 26.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NH-12 | IC50 | 2208.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NKM-1 | IC50 | 7.647 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NMC-G1 | IC50 | 11.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | no-10 | IC50 | 27094.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | no-11 | IC50 | 85570.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NOMO-1 | IC50 | 4201.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NOS-1 | IC50 | 1305.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NTERA-2-cl-D1 | IC50 | 0.1391 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NUGC-3 | IC50 | 1130.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | NY | IC50 | 5911.76 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OAW-28 | IC50 | 9206.46 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OAW-42 | IC50 | 831.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OCI-AML2 | IC50 | 2255.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OCUB-M | IC50 | 1813.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OE19 | IC50 | 2143.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OE33 | IC50 | 2752.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OMC-1 | IC50 | 11894.07 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ONS-76 | IC50 | 853.91 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OPM-2 | IC50 | 104065.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OS-RC-2 | IC50 | 3023.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-3 | IC50 | 123331.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-4 | IC50 | 4410.35 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-5 | IC50 | 4748.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | OVCAR-8 | IC50 | 0.4763 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | P12-Ichikawa | IC50 | 5545.75 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | P30-OHK | IC50 | 7095.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | P31-FUJ | IC50 | 459554.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PA-1 | IC50 | 2015.27 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PANC-03-27 | IC50 | 316.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PANC-08-13 | IC50 | 12052.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PANC-1 | Activity | nan | None | 10.1016/j.bmc.2015.04.004 |
| Homo sapiens | Panc1005 | IC50 | 256.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PC-14 | IC50 | 182.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PC-3 | IC50 | 13314.58 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PF-382 | IC50 | 426.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PFSK-1 | IC50 | 33443.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PLC-PRF-5 | IC50 | 281030.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | PSN1 | IC50 | 138.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | QIMR-WIL | IC50 | 636.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Raji | IC50 | 1847.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | Ramos-2G6-4C10 | IC50 | 9881.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RCC10RGB | IC50 | 70564.35 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RCM-1 | IC50 | 1261.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RD | IC50 | 105697.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | REH | IC50 | 13.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RERF-LC-MS | IC50 | 48685.34 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RH-1 | IC50 | 152.21 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RKO | IC50 | 524.24 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RL | IC50 | 2273648.3 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RMG-I | IC50 | 0.1319 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RO82-W-1 | IC50 | 338970.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-2650 | IC50 | 633.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-6666 | IC50 | 445.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-7951 | IC50 | 1244.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-8226 | IC50 | 906353.13 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI 8402 | IC50 | 30739.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RPMI-8866 | IC50 | 7909.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RS4-11 | IC50 | 1.643 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RT-112 | IC50 | 2319.57 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RT-4 | IC50 | 5.856 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RVH-421 | IC50 | 2571.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | RXF 393 | IC50 | 175594.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | S-117 | IC50 | 90244.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SAOS-2 | IC50 | 171.96 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SAS | IC50 | 3261.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SBC-1 | IC50 | 370001.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SBC-5 | IC50 | 623.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-15 | IC50 | 27631.49 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-25 | IC50 | 415.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-3 | IC50 | 3206.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-4 | IC50 | 2430.2 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCC-9 | IC50 | 403356.18 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCH | IC50 | 443936.71 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SCLC-21H | IC50 | 576782.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SF-126 | IC50 | 3089.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SF-268 | IC50 | 1317.97 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SF-295 | IC50 | 21.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SF-539 | IC50 | 393.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SH-4 | IC50 | 7847.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SHP77 | IC50 | 142134.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SIG-M5 | IC50 | 586.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SiHa | IC50 | 5171416.94 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SIMA | IC50 | 6930.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SJRH30 | IC50 | 414.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SJSA-1 | IC50 | 2187.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-CO-1 | IC50 | 246.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SKG-IIIa | IC50 | 136468.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-HEP1 | IC50 | 414.93 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-LMS-1 | IC50 | 2657.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-LU-1 | IC50 | 998.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-1 | IC50 | 260262.31 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-2 | IC50 | 8485.48 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-24 | IC50 | 23295.22 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-28 | IC50 | 1864417.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL3 | IC50 | 22175.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MEL-30 | IC50 | 376.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MES-1 | IC50 | 3074.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-MM-2 | IC50 | 23239.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-N-AS | IC50 | 1950948.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-N-DZ | IC50 | 169559.86 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-NEP-1 | IC50 | 31880.04 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-N-FI | IC50 | 2102953.37 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-OV-3 | IC50 | 4884.26 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-PN-DW | IC50 | 1452.78 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SK-UT-1 | IC50 | 6.293 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SN12C | IC50 | 315445.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNB-75 | IC50 | 1608.92 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNG-M | IC50 | 830.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU1 | IC50 | 2840.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-16 | IC50 | 16134239.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-387 | IC50 | 924.72 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-423 | IC50 | 867.39 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-449 | IC50 | 388.51 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-475 | IC50 | 67500.77 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-5 | IC50 | 643.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-C1 | IC50 | 81994.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SNU-C2B | IC50 | 2324.84 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SR | IC50 | 29.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | ST486 | IC50 | 6394.05 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SU-DHL-1 | IC50 | 2049.45 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SUP-T1 | IC50 | 0.251 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1088 | IC50 | 818212.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW13 | IC50 | 81.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1417 | IC50 | 249231.95 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1463 | IC50 | 23442.11 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1573 | IC50 | 137.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1710 | IC50 | 295.33 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1783 | IC50 | 249.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW1990 | IC50 | 4244.02 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW48 | IC50 | 546.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW-620 | IC50 | 3557.38 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW626 | IC50 | 1408.25 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW684 | IC50 | 3866616.06 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW756 | IC50 | 11375.66 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW780 | IC50 | 8144303.46 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW837 | IC50 | 1606.42 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW872 | IC50 | 3452.41 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW948 | IC50 | 354303.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW 954 | IC50 | 9.572 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW 962 | IC50 | 1954.52 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | SW982 | IC50 | 417.43 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T-24 | IC50 | 719.91 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T47D | IC50 | 168098.65 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T84 | IC50 | 13459.19 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | T98G | IC50 | 63734.82 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TALL-1 | IC50 | 243879.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TCC-SUP | IC50 | 15941.87 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-1 | IC50 | 6425.07 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-10 | IC50 | 783.12 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-11 | IC50 | 6084.59 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-12 | IC50 | 718.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-15 | IC50 | 3223.15 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-441-T | IC50 | 24615.32 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-5 | IC50 | 7964.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-6 | IC50 | 12385.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-8 | IC50 | 376.69 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TE-9 | IC50 | 33976.56 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TGBC1TKB | IC50 | 74139.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TGBC24TKB | IC50 | 204139.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TGW | IC50 | 65750.35 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | THP-1 | IC50 | 92486.81 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TK-10 | IC50 | 998.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TT | IC50 | 59150.08 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TUR | IC50 | 18851.85 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | TYK-nu | IC50 | 3030.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-118-MG | IC50 | 65664.67 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-251 | IC50 | 4363.14 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-266 | IC50 | 282117.88 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U2OS | IC50 | 264547.55 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-698-M | IC50 | 13006.5 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | U-87 MG | IC50 | 11057.16 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-257 | IC50 | 234102.96 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-62 | IC50 | 187719.53 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-812 | IC50 | 99595.1 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UACC-893 | IC50 | 129776.79 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UMC-11 | IC50 | 2356257.89 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UMUC3 | IC50 | 955.61 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | UO-31 | IC50 | 934.36 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | VA-ES-BJ | IC50 | 260.47 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | VM-CUB-1 | IC50 | 4916.68 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | VMRC-RCZ | IC50 | 2689.62 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | WM-115 | IC50 | 7093.44 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | WSU-NHL | IC50 | 31633.98 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | YAPC | IC50 | 4189492.99 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | YKG-1 | IC50 | 3255.83 | nM | 10.6019/CHEMBL1201861 |
| Homo sapiens | YT | IC50 | 1315.67 | nM | 10.6019/CHEMBL1201861 |
| Mus musculus | L1210 | IC50 | 1700.0 | nM | 10.1021/jm00107a005 |
| Mus musculus | L1210 | Log CR | 0.24 | None | 10.1021/jm00169a014 |
| Mus musculus | Mus musculus | Control | 40.1 | % | 10.1021/jm00186a006 |
| Mus musculus | Mus musculus | Control | 56.4 | % | 10.1021/jm00186a006 |
| Mus musculus | Mus musculus | Control | 61.9 | % | 10.1021/jm00186a006 |
| Mus musculus | Mus musculus | Control | 66.1 | % | 10.1021/jm00186a006 |
| Mus musculus | Mus musculus | Control | 67.9 | % | 10.1021/jm00186a006 |
| Mus musculus | Mus musculus | Control | 69.8 | % | 10.1021/jm00186a006 |
| Mus musculus | Mus musculus | Control | 79.1 | % | 10.1021/jm00186a006 |
| Mus musculus | Mus musculus | Control | 86.0 | % | 10.1021/jm00186a006 |
| Rattus norvegicus | Rattus norvegicus | Activity | 55.0 | % | 10.1021/jm00399a014 |
| Rattus norvegicus | Rattus norvegicus | Activity | 75.0 | % | 10.1021/jm00399a014 |
| Rattus norvegicus | Rattus norvegicus | Activity | 85.0 | % | 10.1021/jm00399a014 |
| Rattus norvegicus | Rattus norvegicus | Pc | 1.4e-08 | cm s-1 | 10.1021/jm00180a022 |
| Salmonella enterica subsp. enterica serovar Typhimurium | Salmonella typhimurium | MIC | 0.19 | ug.mL-1 | 10.1128/aac.01016-08 |
| Salmonella enterica subsp. enterica serovar Typhimurium | Salmonella typhimurium | MIC | 0.4 | ug.mL-1 | 10.1128/aac.00205-08 |
| Salmonella enterica subsp. enterica serovar Typhimurium | Salmonella typhimurium | MIC | 1.8 | ug.mL-1 | 10.1128/aac.00205-08 |
| None | BC1 cell line | IC50 | 3918.12 | nM | 10.6019/CHEMBL1201861 |
| 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 | NON-PROTEIN TARGET | Hepatotoxicity (acute) | 0.0 | % | 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) | 0.0 | % | 10.1016/s0399-8320(04)95062-2 |
| None | NON-PROTEIN TARGET | Hepatotoxicity (moderate) | 1.0 | None | 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 | 517.0 | nM | 10.1021/jm011010t |
| None | NON-PROTEIN TARGET | IC50 | 519.0 | nM | 10.1021/jm011010t |
| None | No relevant target | LogD | -2.38 | None | 10.1021/jm00169a014 |
| None | No relevant target | LogP | -3.3 | None | 10.1021/jm00180a022 |
| None | Nucleic Acid | Activity | 70.0 | % | 10.1021/np50078a006 |
| None | Nucleic Acid | Inhibition | nan | % | 10.1016/j.bmcl.2011.12.103 |
| None | Unchecked | Hepatotoxicity (acute) | 0.0 | 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) | 0.0 | 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) | 0.0 | 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 | 10000.0 | nM | 10.1007/s00044-012-0272-y |