BDBM50070048 (4aR,10bR)-4,10b-Dimethyl-8-thiophen-2-yl-1,4,4a,5,6,10b-hexahydro-2H-benzo[f]quinolin-3-one::CHEMBL341088

SMILES: CN1[C@@H]2CCc3cc(ccc3[C@@]2(C)CCC1=O)-c1cccs1

InChI Key: InChIKey=GUFSVRJDNQUVLC-IEBWSBKVSA-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 = 50070048   

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 (Homo sapiens (Human))	BDBM50070048 ((4aR,10bR)-4,10b-Dimethyl-8-thiophen-2-yl-1,4,4a,5...) Show SMILES CN1[C@@H]2CCc3cc(ccc3[C@@]2(C)CCC1=O)-c1cccs1 Show InChI InChI=1S/C19H21NOS/c1-19-10-9-18(21)20(2)17(19)8-6-13-12-14(5-7-15(13)19)16-4-3-11-22-16/h3-5,7,11-12,17H,6,8-10H2,1-2H3/t17-,19-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against Steroid 5-alpha-reductase type 2 as [3H]-T to [3H]-DHT conversion human prostate nuclear membrane				Bioorg Med Chem Lett 8: 395-8 (1999) BindingDB Entry DOI: 10.7270/Q2CN732C
					More data for this Ligand-Target Pair
5α-Reductase 1 (5α-R1) (Homo sapiens (Human))	BDBM50070048 ((4aR,10bR)-4,10b-Dimethyl-8-thiophen-2-yl-1,4,4a,5...) Show SMILES CN1[C@@H]2CCc3cc(ccc3[C@@]2(C)CCC1=O)-c1cccs1 Show InChI InChI=1S/C19H21NOS/c1-19-10-9-18(21)20(2)17(19)8-6-13-12-14(5-7-15(13)19)16-4-3-11-22-16/h3-5,7,11-12,17H,6,8-10H2,1-2H3/t17-,19-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against Steroid 5-alpha-reductase type 1 enzyme based on the conversion of [3H]-T to [3H]-DHT in nuclear membrane preparations fr...				Bioorg Med Chem Lett 8: 395-8 (1999) BindingDB Entry DOI: 10.7270/Q2CN732C
					More data for this Ligand-Target Pair