Neplanocin A
AlkaPlorer ID: AK011116
Synonym: None
IUPAC Name: (1S,2R,5R)-5-(6-aminopurin-9-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol
Structure
SMILES: NC1=NC=NC2=C1N=CN2[C@@H]1C=C(CO)[C@@H](O)[C@H]1O
InChI: InChI=1S/C11H13N5O3/c12-10-7-11(14-3-13-10)16(4-15-7)6-1-5(2-17)8(18)9(6)19/h1,3-4,6,8-9,17-19H,2H2,(H2,12,13,14)/t6-,8-,9+/m1/s1
InChIKey: XUGWUUDOWNZAGW-VDAHYXPESA-N
Reference
PubChem CID: 72968
CAS: 72877-50-0
LOTUS: LTS0002698
SuperNatural Ⅲ: SN0440299-01
{NPAtlas: NPA013055
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Actinoplanes regularis | Actinoplanes | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 263.257
TPSA?: 130.31
MolLogP?: -1.3963000000000003
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bos taurus | Adenosine deaminase | Compound remaining | 0.0 | % | 10.1021/jm00080a018 |
| Bos taurus | Adenosine deaminase | Compound remaining | 5.0 | % | 10.1021/jm00080a018 |
| Bos taurus | Monoamine oxidase A | Activity | nan | None | 10.1021/jm800656v |
| Canis lupus familiaris | MDCK | IC50 | 20.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Canis lupus familiaris | MDCK | MIC | 20.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Canis lupus familiaris | MDCK | MIC50 | 0.3 | ug.mL-1 | 10.1021/jm00006a023 |
| Canis lupus familiaris | MDCK | MIC50 | 1.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Canis lupus familiaris | MDCK | MIC50 | 1.2 | ug.mL-1 | 10.1021/jm00030a014 |
| Canis lupus familiaris | MDCK | MIC50 | 2.8 | ug.mL-1 | 10.1021/jm00030a014 |
| Canis lupus familiaris | MDCK | MIC50 | 3.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Canis lupus familiaris | MDCK | MIC50 | 4.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Chlorocebus sabaeus | Vero | CC50 | 0.5 | ug.mL-1 | 10.1021/jm950853f |
| Chlorocebus sabaeus | Vero | CC50 | 2.0 | ug.mL-1 | 10.1021/jm950853f |
| Chlorocebus sabaeus | Vero | CC50 | 4.0 | ug.mL-1 | 10.1021/jm950853f |
| Chlorocebus sabaeus | Vero | CC50 | 10.0 | ug.mL-1 | 10.1021/jm950853f |
| Chlorocebus sabaeus | Vero | CC50 | 152.0 | ug.mL-1 | 10.1021/jm950853f |
| Chlorocebus sabaeus | Vero | EC50 | 0.03 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | EC50 | 0.14 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | EC50 | 0.21 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | EC50 | 100.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | ED50 | 0.24 | ug ml-1 | 10.1016/S0960-894X(01)80163-3 |
| Chlorocebus sabaeus | Vero | IC50 | 0.2 | ug.mL-1 | 10.1021/jm00080a018 |
| Chlorocebus sabaeus | Vero | IC50 | 0.21 | ug.mL-1 | 10.1021/jm00080a018 |
| Chlorocebus sabaeus | Vero | IC50 | 0.26 | ug.mL-1 | 10.1016/S0960-894X(01)80163-3 |
| Chlorocebus sabaeus | Vero | IC50 | 0.4 | ug.mL-1 | 10.1021/jm00080a018 |
| Chlorocebus sabaeus | Vero | IC50 | 0.5 | ug.mL-1 | 10.1021/jm960145+ |
| Chlorocebus sabaeus | Vero | IC50 | 0.7 | ug.mL-1 | 10.1021/jm960145+ |
| Chlorocebus sabaeus | Vero | IC50 | 0.74 | ug.mL-1 | 10.1021/jm950853f |
| Chlorocebus sabaeus | Vero | IC50 | 1.0 | ug.mL-1 | 10.1021/jm950853f |
| Chlorocebus sabaeus | Vero | IC50 | 1.5 | ug.mL-1 | 10.1021/jm960145+ |
| Chlorocebus sabaeus | Vero | IC50 | 2.0 | ug.mL-1 | 10.1021/jm960145+ |
| Chlorocebus sabaeus | Vero | IC50 | 4.3 | ug.mL-1 | 10.1021/jm00080a018 |
| Chlorocebus sabaeus | Vero | IC50 | 7.0 | ug.mL-1 | 10.1021/jm960145+ |
| Chlorocebus sabaeus | Vero | IC50 | 10.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | IC50 | 10.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Chlorocebus sabaeus | Vero | IC50 | 20.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | IC50 | 40.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Chlorocebus sabaeus | Vero | IC50 | 40.0 | ug.mL-1 | 10.1021/jm960145+ |
| Chlorocebus sabaeus | Vero | IC50 | 50.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | IC50 | 57.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | IC50 | 100.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| Chlorocebus sabaeus | Vero | IC50 | 152.0 | ug.mL-1 | 10.1016/S0960-894X(01)80163-3 |
| Chlorocebus sabaeus | Vero | IC50 | 155.0 | ug.mL-1 | 10.1021/jm960145+ |
| Chlorocebus sabaeus | Vero | IC50 | 3500.0 | nM | 10.1021/jm010256v |
| Chlorocebus sabaeus | Vero | IC50 | 580000.0 | nM | 10.1021/jm010374i |
| Chlorocebus sabaeus | Vero | MIC | 0.2 | ug.mL-1 | 10.1021/jm00096a012 |
| Chlorocebus sabaeus | Vero | MIC | 0.4 | ug.mL-1 | 10.1021/jm00096a012 |
| Chlorocebus sabaeus | Vero | MIC | 40.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Chlorocebus sabaeus | Vero | MIC50 | 0.2 | ug.mL-1 | 10.1021/jm00006a023 |
| Chlorocebus sabaeus | Vero | MIC50 | 0.2 | ug.mL-1 | 10.1021/jm00035a020 |
| Chlorocebus sabaeus | Vero | MIC50 | 0.4 | ug.mL-1 | 10.1021/jm00030a014 |
| Chlorocebus sabaeus | Vero | MIC50 | 0.7 | ug.mL-1 | 10.1021/jm00006a023 |
| Chlorocebus sabaeus | Vero | MIC50 | 0.7 | ug.mL-1 | 10.1021/jm00030a014 |
| Chlorocebus sabaeus | Vero | MIC50 | 0.7 | ug.mL-1 | 10.1021/jm00035a020 |
| Chlorocebus sabaeus | Vero | MIC50 | 1.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Chlorocebus sabaeus | Vero | MIC50 | 1.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Chlorocebus sabaeus | Vero | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Chlorocebus sabaeus | Vero | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Chlorocebus sabaeus | Vero | MIC50 | 7.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Chlorocebus sabaeus | Vero | MIC50 | 7.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Chlorocebus sabaeus | Vero | MIC50 | 10.0 | ug.mL-1 | 10.1021/jm00030a014 |
| Chlorocebus sabaeus | Vero | MIC50 | 40.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Cowpox virus | Cowpox virus | EC50 | 8400.0 | nM | 10.1016/j.bmc.2006.10.043 |
| Cowpox virus | Cowpox virus | IC50 | 300000.0 | nM | 10.1016/j.bmc.2006.10.043 |
| Homo sapiens | A549 | IC50 | 1220.0 | nM | 10.1021/acs.jmedchem.5b00553 |
| Homo sapiens | A549 | IC50 | 2160.0 | nM | 10.1016/j.ejmech.2018.06.003 |
| Homo sapiens | Adenosylhomocysteinase | Activity | 0.0 | % | 10.1021/jm00398a002 |
| Homo sapiens | Adenosylhomocysteinase | Activity | nan | None | 10.1021/jm1010836 |
| Homo sapiens | Adenosylhomocysteinase | Activity remaining | 0.0 | % | 10.1021/jm025557z |
| Homo sapiens | Adenosylhomocysteinase | Activity remaining | 97.0 | % | 10.1021/jm025557z |
| Homo sapiens | Adenosylhomocysteinase | Activity remaining | 98.0 | % | 10.1021/jm025557z |
| Homo sapiens | Adenosylhomocysteinase | Activity remaining | 99.0 | % | 10.1021/jm025557z |
| Homo sapiens | Adenosylhomocysteinase | Activity remaining | 100.0 | % | 10.1021/jm025557z |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 0.004 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 0.004 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 1.5 | nM | 10.1016/j.bmcl.2014.04.034 |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 7.2 | nM | 10.1016/S0960-894X(01)81249-X |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 10.0 | nM | 10.1016/j.bmcl.2014.04.034 |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 470.0 | nM | 10.1021/acs.jmedchem.5b00553 |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 870.0 | nM | 10.1021/jm1010836 |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 890.0 | nM | 10.1016/j.bmcl.2004.02.039 |
| Homo sapiens | Adenosylhomocysteinase | IC50 | 900.0 | nM | 10.1016/j.bmc.2009.07.061 |
| Homo sapiens | Adenosylhomocysteinase | IC50 | nan | nM | 10.1021/jm00117a011 |
| Homo sapiens | Adenosylhomocysteinase | Inhibition | 0.05 | % | 10.1021/jm0004446 |
| Homo sapiens | Adenosylhomocysteinase | Inhibition | 2.61 | % | 10.1021/jm0004446 |
| Homo sapiens | Adenosylhomocysteinase | Inhibition | 7.91 | % | 10.1021/jm0004446 |
| Homo sapiens | Adenosylhomocysteinase | Inhibition | 21.83 | % | 10.1021/jm0004446 |
| Homo sapiens | Adenosylhomocysteinase | k2 | 1.98 | min-1 | 10.1021/jm00088a013 |
| Homo sapiens | Adenosylhomocysteinase | Ki | 3.8 | nM | 10.1021/jm00088a013 |
| Homo sapiens | Adenosylhomocysteinase | Ki | 3.8 | nM | 10.1021/jm00117a011 |
| Homo sapiens | Adenosylhomocysteinase | Ki | 3.8 | nM | 10.1021/jm00398a002 |
| Homo sapiens | Adenosylhomocysteinase | NAD content | 0.0 | M (M of enzyme)-1 | 10.1021/jm00398a002 |
| Homo sapiens | CCRF-CEM | IC50 | 1.12 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | CCRF-CEM | IC50 | 1200.0 | nM | 10.1021/jm010256v |
| Homo sapiens | E6SM | CC50 | 0.7 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | E6SM | CC50 | 7.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | E6SM | CC50 | 40.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | E6SM | CC50 | 70.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | E6SM | IC50 | 0.4 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | E6SM | IC50 | 0.7 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | E6SM | IC50 | 7.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | E6SM | IC50 | 20.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | E6SM | IC50 | 40.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | E6SM | IC50 | 70.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | E6SM | MIC | 0.2 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | E6SM | MIC | 4.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | E6SM | MIC | 40.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | E6SM | MIC50 | 0.2 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | E6SM | MIC50 | 0.2 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | E6SM | MIC50 | 0.2 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | E6SM | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | E6SM | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | E6SM | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | E6SM | MIC50 | 20.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | E6SM | MIC50 | 20.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | E6SM | MIC50 | 70.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | E6SM | MIC50 | 70.0 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | E6SM | MIC50 | 70.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | E6SM | MIC50 | 100.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | E6SM | MIC50 | 100.0 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | E6SM | MIC50 | 100.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | HCT-116 | IC50 | 900.0 | nM | 10.1021/acs.jmedchem.5b00553 |
| Homo sapiens | HCT-116 | IC50 | 1450.0 | nM | 10.1016/j.ejmech.2018.06.003 |
| Homo sapiens | HEL | CC50 | 0.3 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HEL | CC50 | 0.4 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HEL | CC50 | 7.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HEL | CC50 | 9.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HEL | CC50 | 10.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HEL | CC50 | 15.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HEL | CC50 | 20.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HEL | IC50 | 0.2 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HEL | IC50 | 0.3 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HEL | IC50 | 0.3 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | HEL | IC50 | 2.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HEL | IC50 | 5.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HEL | IC50 | 8.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HEL | IC50 | 9.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | HEL | IC50 | 10.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | HEL | IC50 | 16.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HEL | IC50 | 20.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | HEL | MIC | 0.4 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | HEL | MIC | 5.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | HEL | MIC | 8.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | HEL | MIC50 | 0.2 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | HEL | MIC50 | 0.4 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HEL | MIC50 | 0.4 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | HEL | MIC50 | 0.6 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HEL | MIC50 | 0.6 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | HEL | MIC50 | 1.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | HEL | MIC50 | 3.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HEL | MIC50 | 3.5 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | HEL | MIC50 | 4.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HEL | MIC50 | 5.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HEL | MIC50 | 6.0 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | HEL | MIC50 | 6.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | HEL | MIC50 | 20.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HeLa | CC50 | 2.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HeLa | CC50 | 40.0 | ug.mL-1 | 10.1021/jm950853f |
| Homo sapiens | HeLa | IC50 | 0.2 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HeLa | IC50 | 2.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | HeLa | IC50 | 20.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HeLa | IC50 | 40.0 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | HeLa | IC50 | 40.0 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | HeLa | MIC | 0.2 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | HeLa | MIC | 10.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | HeLa | MIC | 40.0 | ug.mL-1 | 10.1021/jm00096a012 |
| Homo sapiens | HeLa | MIC50 | 0.2 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | HeLa | MIC50 | 1.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HeLa | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HeLa | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | HeLa | MIC50 | 2.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | HeLa | MIC50 | 10.0 | ug.mL-1 | 10.1021/jm00030a014 |
| Homo sapiens | HeLa | MIC50 | 40.0 | ug.mL-1 | 10.1021/jm00006a023 |
| Homo sapiens | HeLa | MIC50 | 40.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Homo sapiens | Homo sapiens | Cytotoxicity | 0.0 | None | 10.1021/jm00105a064 |
| Homo sapiens | Homo sapiens | Cytotoxicity | 340.0 | None | 10.1021/jm00105a064 |
| Homo sapiens | Homo sapiens | Cytotoxicity | 400.0 | None | 10.1021/jm00105a064 |
| Homo sapiens | KATO III stomach cancer cell line | IC50 | 220.0 | nM | 10.1021/jm010374i |
| Homo sapiens | MCF7 | IC50 | 25000.0 | nM | 10.1016/j.bmc.2015.07.045 |
| Homo sapiens | MDA-MB-231 | IC50 | 400.0 | nM | 10.1021/acs.jmedchem.5b00553 |
| Homo sapiens | MDA-MB-231 | IC50 | 860.0 | nM | 10.1016/j.ejmech.2018.06.003 |
| Homo sapiens | MDA-MB-231 | IC50 | 25000.0 | nM | 10.1016/j.bmc.2015.07.045 |
| Homo sapiens | MOLT-4 | IC50 | 2.34 | ug.mL-1 | 10.1021/jm960145+ |
| Homo sapiens | MT4 | IC50 | 0.006 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | MT4 | IC50 | 0.02 | ug.mL-1 | 10.1021/jm00080a018 |
| Homo sapiens | PC-3 | IC50 | 2140.0 | nM | 10.1016/j.ejmech.2018.06.003 |
| Homo sapiens | PC-3 | IC50 | 3700.0 | nM | 10.1021/acs.jmedchem.5b00553 |
| Homo sapiens | PO3 | Cytotoxicity | 80.0 | None | 10.1021/jm00105a064 |
| Homo sapiens | SK-HEP1 | IC50 | 2360.0 | nM | 10.1016/j.ejmech.2018.06.003 |
| Homo sapiens | SNU-638 | IC50 | 820.0 | nM | 10.1016/j.ejmech.2018.06.003 |
| Human alphaherpesvirus 1 | Human alphaherpesvirus 1 | Activity | nan | None | 10.1021/jm00385a032 |
| Human alphaherpesvirus 2 | Human alphaherpesvirus 2 | Activity | nan | None | 10.1021/jm00385a032 |
| Human alphaherpesvirus 2 | Human alphaherpesvirus 2 | VR | 1.39 | None | 10.1021/jm00389a015 |
| Human betaherpesvirus 5 | Human betaherpesvirus 5 | EC50 | 0.2 | ug.mL-1 | 10.1016/0960-894X(95)00270-4 |
| Human immunodeficiency virus 1 | Human immunodeficiency virus 1 | EC50 | 100.0 | nM | 10.1021/jm010256v |
| Human respirovirus 3 | Human respirovirus 3 | VR | 1.6 | None | 10.1021/jm00389a015 |
| Influenza A virus | Influenza A virus | EC50 | 20.0 | ug.mL-1 | 10.1016/0960-894X(95)00270-4 |
| Influenza B virus | Influenza B virus | EC50 | 20.0 | ug.mL-1 | 10.1016/0960-894X(95)00270-4 |
| Measles morbillivirus | Measles morbillivirus | IC50 | 0.1 | ug.mL-1 | 10.1021/jm960145+ |
| Measles morbillivirus | Measles morbillivirus | VR | 0.75 | None | 10.1021/jm00389a015 |
| Mumps orthorubulavirus | Mumps virus | IC50 | 0.11 | ug.mL-1 | 10.1021/jm960145+ |
| Mus musculus | Adenosylhomocysteinase | IC50 | 50.0 | nM | 10.1021/jm00117a011 |
| Mus musculus | Adenosylhomocysteinase | Ki | 3.0 | nM | 10.1021/jm00030a014 |
| Mus musculus | FM3A | IC50 | 0.022 | ug.mL-1 | 10.1021/jm960145+ |
| Mus musculus | L1210 | Cytotoxicity | 500.0 | None | 10.1021/jm00105a064 |
| Mus musculus | L1210 | IC50 | 0.027 | ug.mL-1 | 10.1021/jm960145+ |
| Mus musculus | L1210 | ID50 | 1.0 | M | 10.1021/jm00385a032 |
| Mus musculus | L1210 | Inhibition | 50.0 | % | 10.1021/jm00385a032 |
| Mus musculus | L929 | IC50 | 5.2 | nM | 10.1021/jm00030a014 |
| Mus musculus | MC-38 | Cytotoxicity | 0.0 | None | 10.1021/jm00105a064 |
| Plasmodium berghei | Plasmodium berghei | Parasitemia | 12.0 | % | 10.1021/jm010374i |
| Plasmodium berghei | Plasmodium berghei | Parasitemia | 20.0 | % | 10.1021/jm010374i |
| Plasmodium berghei | Plasmodium berghei | Parasitemia | 21.0 | % | 10.1021/jm010374i |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 200.0 | nM | 10.1021/jm010374i |
| Punta Toro virus | Punta Toro virus | EC50 | nan | None | 10.1016/j.bmc.2006.10.043 |
| Punta Toro virus | Punta Toro virus | IC50 | nan | None | 10.1016/j.bmc.2006.10.043 |
| Rattus norvegicus | Adenosylhomocysteinase | Ki | 8.39 | nM | 10.1021/acs.jmedchem.9b01877 |
| Respiratory syncytial virus | Respiratory syncytial virus | MIC50 | 1.0 | ug.mL-1 | 10.1021/jm00035a020 |
| Respiratory syncytial virus | Respiratory syncytial virus | MIC50 | 1.2 | ug.mL-1 | 10.1021/jm00006a023 |
| Respiratory syncytial virus | Respiratory syncytial virus | MIC50 | 1.2 | ug.mL-1 | 10.1021/jm00030a014 |
| Severe acute respiratory syndrome-related coronavirus | SARS-CoV | EC50 | nan | None | 10.1016/j.bmc.2006.10.043 |
| Severe acute respiratory syndrome-related coronavirus | SARS-CoV | IC50 | nan | None | 10.1016/j.bmc.2006.10.043 |
| Vaccinia virus | Vaccinia virus | IC50 | 80.0 | nM | 10.1021/jm00117a011 |
| Vaccinia virus | Vaccinia virus | VR | 1.38 | None | 10.1021/jm00389a015 |
| Vesicular stomatitis virus | Vesicular stomatitis virus | Activity | nan | None | 10.1021/jm00385a032 |
| Vesicular stomatitis virus | Vesicular stomatitis virus | EC50 | 0.38 | ug.mL-1 | 10.1016/0960-894X(95)00270-4 |
| Vesicular stomatitis virus | Vesicular stomatitis virus | IC50 | 0.25 | ug.mL-1 | 10.1021/jm960145+ |
| West Nile virus | West Nile virus | EC50 | 51000.0 | nM | 10.1016/j.bmc.2006.10.043 |
| West Nile virus | West Nile virus | EC50 | 51000.0 | nM | 10.1021/jm010256v |
| West Nile virus | West Nile virus | IC50 | nan | None | 10.1016/j.bmc.2006.10.043 |
| None | ADMET | IC50 | 40.0 | ug.mL-1 | 10.1021/jm00080a018 |
| None | ADMET | IC50 | 44600.0 | nM | 10.1021/jm010256v |
| None | ADMET | Therapeutic index | 0.2 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 1.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 12.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 71.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 161.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 230.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 271.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 360.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ADMET | Therapeutic index | 1667.0 | None | 10.1016/s0960-894x(02)00841-7 |
| None | ESM | IC50 | 0.2 | ug.mL-1 | 10.1021/jm00080a018 |
| None | ESM | IC50 | 4.0 | ug.mL-1 | 10.1021/jm00080a018 |
| None | ESM | IC50 | 7.0 | ug.mL-1 | 10.1021/jm00080a018 |
| None | ESM | IC50 | 10.0 | ug.mL-1 | 10.1021/jm00080a018 |
| None | ESM | IC50 | 20.0 | ug.mL-1 | 10.1021/jm00080a018 |
| None | ESM | IC50 | 40.0 | ug.mL-1 | 10.1021/jm00080a018 |
| None | NON-PROTEIN TARGET | Cytotoxicity | 40.0 | None | 10.1021/jm00105a064 |
| None | NON-PROTEIN TARGET | Cytotoxicity | 100.0 | None | 10.1021/jm00105a064 |
| None | NON-PROTEIN TARGET | EC50 | 0.1 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | EC50 | 0.26 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | EC50 | 2.62 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | EC50 | 100.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | IC50 | 23.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | IC50 | 31.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | IC50 | 36.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | IC50 | 42.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | IC50 | 100.0 | ug.mL-1 | 10.1016/s0960-894x(02)00841-7 |
| None | NON-PROTEIN TARGET | IC50 | 700.0 | nM | 10.1021/acs.jmedchem.5b00553 |
| None | NON-PROTEIN TARGET | IC50 | 4500.0 | nM | 10.1021/acs.jmedchem.5b00553 |
| None | NON-PROTEIN TARGET | IC50 | 25000.0 | nM | 10.1016/j.bmc.2015.07.045 |
| None | NON-PROTEIN TARGET | Selectivity index | 1.1 | None | 10.1016/S0960-894X(01)80163-3 |
| None | NON-PROTEIN TARGET | Survival | 0.0 | None | 10.1021/jm010374i |
| None | NON-PROTEIN TARGET | Survival | 5.0 | None | 10.1021/jm010374i |
| None | PRK | IC50 | 0.2 | ug.mL-1 | 10.1021/jm00080a018 |
| None | PRK | IC50 | 40.0 | ug.mL-1 | 10.1021/jm00080a018 |
| None | Unchecked | EC50 | 5.0 | mg kg-1 day-1 | 10.1021/jm010374i |
| None | Unchecked | IC50 | 0.9 | nM | 10.1016/j.bmc.2014.07.051 |
| None | Unchecked | Inhibition | 30.0 | % | 10.1039/D1MD00167A |
| None | Unchecked | k2/KI | 0.52 | nM-1 min-1 | 10.1021/jm00088a013 |
