BDBM50382185 CHEMBL1907447

SMILES: COc1cccc(c1)-c1csc(Nc2ccc(Oc3ccccc3)cc2)n1

InChI Key: InChIKey=KAOBLCHOHKAJSL-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 = 50382185   

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
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50382185 (CHEMBL1907447) Show SMILES COc1cccc(c1)-c1csc(Nc2ccc(Oc3ccccc3)cc2)n1 Show InChI InChI=1S/C22H18N2O2S/c1-25-20-9-5-6-16(14-20)21-15-27-22(24-21)23-17-10-12-19(13-11-17)26-18-7-3-2-4-8-18/h2-15H,1H3,(H,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Arizona Curated by ChEMBL					Assay Description Inhibition of COX2 by fluorescence assay				Bioorg Med Chem Lett 22: 3567-70 (2012) Article DOI: 10.1016/j.bmcl.2012.03.013 BindingDB Entry DOI: 10.7270/Q2RB75MP
					More data for this Ligand-Target Pair