BDBM50450895 CHEMBL4205522

SMILES: Oc1ccc(CC(=O)NCCc2c[nH]c3ccccc23)cc1Cl

InChI Key: InChIKey=DSPXXZPWASCPKT-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50450895   

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
Estradiol 17-beta-dehydrogenase 2 (Homo sapiens (Human))	BDBM50450895 (CHEMBL4205522) Show SMILES Oc1ccc(CC(=O)NCCc2c[nH]c3ccccc23)cc1Cl Show InChI InChI=1S/C18H17ClN2O2/c19-15-9-12(5-6-17(15)22)10-18(23)20-8-7-13-11-21-16-4-2-1-3-14(13)16/h1-6,9,11,21-22H,7-8,10H2,(H,20,23)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
University of Basel Curated by ChEMBL					Assay Description Inhibition of human 17beta-HSD2 expressed in HEK293 cell lysates incubated for 10 mins using [2,4,6,7-3H]-estradiol and NAD+ by scintillation countin...				J Nat Prod 80: 965-974 (2017) Article DOI: 10.1021/acs.jnatprod.6b00950 BindingDB Entry DOI: 10.7270/Q2XD148R
					More data for this Ligand-Target Pair