BDBM50539778 CHEMBL4636106

SMILES: OCc1cccc(c1)-c1ccc2nc(NC(=O)c3ccc(F)cc3Cl)sc2c1

InChI Key: InChIKey=UQNGLLVWPXPKDS-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 = 50539778   

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 E synthase/G/H synthase 2 (Homo sapiens (Human))	BDBM50539778 (CHEMBL4636106) Show SMILES OCc1cccc(c1)-c1ccc2nc(NC(=O)c3ccc(F)cc3Cl)sc2c1 Show InChI InChI=1S/C21H14ClFN2O2S/c22-17-10-15(23)5-6-16(17)20(27)25-21-24-18-7-4-14(9-19(18)28-21)13-3-1-2-12(8-13)11-26/h1-10,26H,11H2,(H,24,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of mPGES1 in human A549 cells assessed as reduction in IL-1beta induced PGE2 release using PGH2 as substrate preincubated for 15 mins foll...				ACS Med Chem Lett 11: 783-789 (2020)
					More data for this Ligand-Target Pair