BDBM50090621 4-(4-Methanesulfonyl-phenyl)-3-(4-methoxy-phenyl)-1-phenyl-1,5-dihydro-pyrrol-2-one::CHEMBL300021

SMILES: COc1ccc(cc1)C1=C(CN(C1=O)c1ccccc1)c1ccc(cc1)S(C)(=O)=O

InChI Key: InChIKey=FJBKKMJBVLOMRG-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50090621   

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
Cyclooxygenase (Homo sapiens (Human))	BDBM50090621 (4-(4-Methanesulfonyl-phenyl)-3-(4-methoxy-phenyl)-...) Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccccc1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C24H21NO4S/c1-29-20-12-8-18(9-13-20)23-22(17-10-14-21(15-11-17)30(2,27)28)16-25(24(23)26)19-6-4-3-5-7-19/h3-15H,16H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
University of Barcelona Curated by ChEMBL					Assay Description Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood				Bioorg Med Chem Lett 10: 1745-8 (2000) BindingDB Entry DOI: 10.7270/Q2ZG6RH7
					More data for this Ligand-Target Pair
Cyclooxygenase-1 (COX-1) (Homo sapiens (Human))	BDBM50090621 (4-(4-Methanesulfonyl-phenyl)-3-(4-methoxy-phenyl)-...) Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccccc1)c1ccc(cc1)S(C)(=O)=O |t:9| Show InChI InChI=1S/C24H21NO4S/c1-29-20-12-8-18(9-13-20)23-22(17-10-14-21(15-11-17)30(2,27)28)16-25(24(23)26)19-6-4-3-5-7-19/h3-15H,16H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.68E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Barcelona Curated by ChEMBL					Assay Description Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation				Bioorg Med Chem Lett 10: 1745-8 (2000) BindingDB Entry DOI: 10.7270/Q2ZG6RH7
					More data for this Ligand-Target Pair