BDBM50179946 1-(3-chloro-11,12-dihydro-6H-dibenzo[b,f]azocin-5-yl)-ethanone::CHEMBL206181

SMILES: CC(=O)N1Cc2ccccc2CCc2ccc(Cl)cc12

InChI Key: InChIKey=AXSZKEZVNUSREF-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 = 50179946   

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))	BDBM50179946 (1-(3-chloro-11,12-dihydro-6H-dibenzo[b,f]azocin-5-...) Show SMILES CC(=O)N1Cc2ccccc2CCc2ccc(Cl)cc12 Show InChI InChI=1S/C17H16ClNO/c1-12(20)19-11-15-5-3-2-4-13(15)6-7-14-8-9-16(18)10-17(14)19/h2-5,8-10H,6-7,11H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	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))	BDBM50179946 (1-(3-chloro-11,12-dihydro-6H-dibenzo[b,f]azocin-5-...) Show SMILES CC(=O)N1Cc2ccccc2CCc2ccc(Cl)cc12 Show InChI InChI=1S/C17H16ClNO/c1-12(20)19-11-15-5-3-2-4-13(15)6-7-14-8-9-16(18)10-17(14)19/h2-5,8-10H,6-7,11H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	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