BDBM50044892 8-Methoxy-4-methyl-1,4,4a,5,6,10b-hexahydro-2H-benzo[f]quinolin-3-one::CHEMBL335919

SMILES: COc1ccc2[C@H]3CCC(=O)N(C)[C@@H]3CCc2c1

InChI Key: InChIKey=IEHRLIRLTIHPQO-ZIAGYGMSSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50044892   

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))	BDBM50044892 (8-Methoxy-4-methyl-1,4,4a,5,6,10b-hexahydro-2H-ben...) Show SMILES COc1ccc2[C@H]3CCC(=O)N(C)[C@@H]3CCc2c1 Show InChI InChI=1S/C15H19NO2/c1-16-14-7-3-10-9-11(18-2)4-5-12(10)13(14)6-8-15(16)17/h4-5,9,13-14H,3,6-8H2,1-2H3/t13-,14-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	115	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory concentration required to inhibit Steroid 5-alpha-reductase type 1 in cultured Hs 68 human foreskin fibroblast cells				Bioorg Med Chem Lett 3: 1157-1162 (1993) Article DOI: 10.1016/S0960-894X(00)80306-6 BindingDB Entry DOI: 10.7270/Q2VD70NP
					More data for this Ligand-Target Pair
5α-Reductase 1 (5α-R1) (Homo sapiens (Human))	BDBM50044892 (8-Methoxy-4-methyl-1,4,4a,5,6,10b-hexahydro-2H-ben...) Show SMILES COc1ccc2[C@H]3CCC(=O)N(C)[C@@H]3CCc2c1 Show InChI InChI=1S/C15H19NO2/c1-16-14-7-3-10-9-11(18-2)4-5-12(10)13(14)6-8-15(16)17/h4-5,9,13-14H,3,6-8H2,1-2H3/t13-,14-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description In vitro inhibition of DHT production in Hs 68 (human genital fibroblast) cells.				J Med Chem 36: 421-3 (1993) BindingDB Entry DOI: 10.7270/Q2T43TQX
					More data for this Ligand-Target Pair