BDBM50032264 4-(2-{(E)-3-[1-(1-Isobutyl-3-methyl-butyl)-1H-indol-5-yl]-but-2-enoylamino}-phenoxy)-butyric acid::CHEMBL95843
SMILES: CC(C)CC(CC(C)C)n1ccc2cc(ccc12)C(\C)=C\C(=O)Nc1ccccc1OCCCC(O)=O
InChI Key: InChIKey=NMSYCYWNCNQZNH-FCDQGJHFSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Steroid 5-alpha-reductase (Rattus norvegicus) | BDBM50032264![]() (4-(2-{(E)-3-[1-(1-Isobutyl-3-methyl-butyl)-1H-indo...) | MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyowa Hakko Kogyo Co., Ltd Curated by ChEMBL | Assay Description Inhibitory activity against Steroid 5-alpha-reductase in prostates from male rats | J Med Chem 38: 2887-92 (1995) Article DOI: 10.1021/jm00015a011 BindingDB Entry DOI: 10.7270/Q2B27Z0N | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Steroid 5-alpha-reductase (Rattus norvegicus) | BDBM50032264![]() (4-(2-{(E)-3-[1-(1-Isobutyl-3-methyl-butyl)-1H-indo...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyowa Hakko Kogyo Co., Ltd. Curated by ChEMBL | Assay Description 5 alpha- reductase inhibitory activity | J Med Chem 39: 5047-52 (1997) Article DOI: 10.1021/jm9601819 BindingDB Entry DOI: 10.7270/Q2TQ6263 | |||||||||||
More data for this Ligand-Target Pair |