BDBM50434470 CHEMBL2385109

SMILES: CN(C)S(=O)(=O)c1ccccc1Cn1nc(c(CC(O)=O)c1C)-c1ccccc1

InChI Key: InChIKey=GYRAVLWEBOFTPP-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 = 50434470   

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
G protein-coupled receptor 44 (Homo sapiens (Human))	BDBM50434470 (CHEMBL2385109) Show SMILES CN(C)S(=O)(=O)c1ccccc1Cn1nc(c(CC(O)=O)c1C)-c1ccccc1 Show InChI InChI=1S/C21H23N3O4S/c1-15-18(13-20(25)26)21(16-9-5-4-6-10-16)22-24(15)14-17-11-7-8-12-19(17)29(27,28)23(2)3/h4-12H,13-14H2,1-3H3,(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	850	n/a	n/a	n/a	n/a	n/a	n/a
Rhône-Poulenc Rorer Curated by ChEMBL					Assay Description Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding preinc...				Bioorg Med Chem Lett 23: 3349-53 (2013) Article DOI: 10.1016/j.bmcl.2013.03.093 BindingDB Entry DOI: 10.7270/Q2C24XSQ
					More data for this Ligand-Target Pair