BDBM50179965 CHEMBL382624::N-[3-(5-acetyl-2-chloro-5,6,11,12-tetrahydro-dibenzo[b,f]azocin-8-yl)-phenyl]-methanesulfonamide

SMILES: CC(=O)N1Cc2cc(ccc2CCc2cc(Cl)ccc12)-c1cccc(NS(C)(=O)=O)c1

InChI Key: InChIKey=SWXZWMCGDZBQHU-UHFFFAOYSA-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 = 50179965   

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
17-beta-hydroxysteroid dehydrogenase type 3 (Homo sapiens (Human))	BDBM50179965 (CHEMBL382624 | N-[3-(5-acetyl-2-chloro-5,6,11,12-t...) Show SMILES CC(=O)N1Cc2cc(ccc2CCc2cc(Cl)ccc12)-c1cccc(NS(C)(=O)=O)c1 Show InChI InChI=1S/C24H23ClN2O3S/c1-16(28)27-15-21-12-19(18-4-3-5-23(14-18)26-31(2,29)30)8-6-17(21)7-9-20-13-22(25)10-11-24(20)27/h3-6,8,10-14,26H,7,9,15H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of 17beta-HSD3				Bioorg Med Chem Lett 16: 1532-6 (2006) Article DOI: 10.1016/j.bmcl.2005.12.039 BindingDB Entry DOI: 10.7270/Q2CV4HBV
					More data for this Ligand-Target Pair
17-beta-hydroxysteroid dehydrogenase type 3 (Homo sapiens (Human))	BDBM50179965 (CHEMBL382624 | N-[3-(5-acetyl-2-chloro-5,6,11,12-t...) Show SMILES CC(=O)N1Cc2cc(ccc2CCc2cc(Cl)ccc12)-c1cccc(NS(C)(=O)=O)c1 Show InChI InChI=1S/C24H23ClN2O3S/c1-16(28)27-15-21-12-19(18-4-3-5-23(14-18)26-31(2,29)30)8-6-17(21)7-9-20-13-22(25)10-11-24(20)27/h3-6,8,10-14,26H,7,9,15H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of 17beta-HSD3 by SEAP assay				Bioorg Med Chem Lett 16: 1532-6 (2006) Article DOI: 10.1016/j.bmcl.2005.12.039 BindingDB Entry DOI: 10.7270/Q2CV4HBV
					More data for this Ligand-Target Pair