BDBM50034159 CHEMBL278490::N-Pentyl-N-((4aR,6aS,7S,11aR)-1,4a,6a-trimethyl-2-oxo-hexadecahydro-indeno[5,4-f]quinolin-7-yl)-butyramide
SMILES: CCCCCN([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)CCC
InChI Key: InChIKey=WBGPDNKNLSWTLR-GQLLQZSASA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
5α-Reductase 1 (5α-R1) (Homo sapiens (Human)) | BDBM50034159 (CHEMBL278490 | N-Pentyl-N-((4aR,6aS,7S,11aR)-1,4a,...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
CHUL Research Center Curated by ChEMBL | Assay Description In vitro inhibition of human steroid 5-alpha-reductase type I in Du-145 cells | J Med Chem 38: 1158-73 (1995) BindingDB Entry DOI: 10.7270/Q2NG4R90 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Steroid 5-alpha-reductase (Homo sapiens (Human)) | BDBM50034159 (CHEMBL278490 | N-Pentyl-N-((4aR,6aS,7S,11aR)-1,4a,...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
CHUL Research Center Curated by ChEMBL | Assay Description In vitro inhibition of human steroid 5-alpha-reductase type 2 in SW-13-transfected cells | J Med Chem 38: 1158-73 (1995) BindingDB Entry DOI: 10.7270/Q2NG4R90 | |||||||||||
More data for this Ligand-Target Pair |