BDBM50526140 CHEMBL4463748

SMILES: Cc1cc(CN(C(=O)CCl)c2nc(cs2)-c2ccccc2O)on1

InChI Key: InChIKey=FCWQIJGQLFKUDK-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 = 50526140   

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
Glutathione transferase omega 1 (Homo sapiens (Human))	BDBM50526140 (CHEMBL4463748) Show SMILES Cc1cc(CN(C(=O)CCl)c2nc(cs2)-c2ccccc2O)on1 Show InChI InChI=1S/C16H14ClN3O3S/c1-10-6-11(23-19-10)8-20(15(22)7-17)16-18-13(9-24-16)12-4-2-3-5-14(12)21/h2-6,9,21H,7-8H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.60	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of CMFDA binding to human N-terminal 6x-His-tagged GSTO1-1 preincubated for 30 mins followed by CMFDA addition and measured after 30 mins ...				J Med Chem 62: 3068-3087 (2019) Article DOI: 10.1021/acs.jmedchem.8b01960
					More data for this Ligand-Target Pair