null

SMILES: CC(C)c1nc2sc(c(-c3ccccc3)n2n1)-c1ccc(cc1)S(C)(=O)=O

InChI Key: InChIKey=UTRQPUXKRUOGHK-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50289324   

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 1 (Homo sapiens (Human))	BDBM50289324 (2-Isopropyl-5-(4-methanesulfonyl-phenyl)-6-phenyl-...) Show SMILES CC(C)c1nc2sc(c(-c3ccccc3)n2n1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C20H19N3O2S2/c1-13(2)19-21-20-23(22-19)17(14-7-5-4-6-8-14)18(26-20)15-9-11-16(12-10-15)27(3,24)25/h4-13H,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested in vitro for the ability to inhibit Prostaglandin G/H synthase 1 in chinese hamster ovary (CHO) cells				Bioorg Med Chem Lett 7: 57-62 (1997) Article DOI: 10.1016/S0960-894X(96)00582-3 BindingDB Entry DOI: 10.7270/Q29W0FG1
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50289324 (2-Isopropyl-5-(4-methanesulfonyl-phenyl)-6-phenyl-...) Show SMILES CC(C)c1nc2sc(c(-c3ccccc3)n2n1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C20H19N3O2S2/c1-13(2)19-21-20-23(22-19)17(14-7-5-4-6-8-14)18(26-20)15-9-11-16(12-10-15)27(3,24)25/h4-13H,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.10E+7	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of COX2 (unknown origin) expressed in CHO cells				Citation and Details Article DOI: 10.1007/s00044-004-0039-1 BindingDB Entry DOI: 10.7270/Q2280BHV
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50289324 (2-Isopropyl-5-(4-methanesulfonyl-phenyl)-6-phenyl-...) Show SMILES CC(C)c1nc2sc(c(-c3ccccc3)n2n1)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C20H19N3O2S2/c1-13(2)19-21-20-23(22-19)17(14-7-5-4-6-8-14)18(26-20)15-9-11-16(12-10-15)27(3,24)25/h4-13H,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested in vitro for the ability to inhibit Prostaglandin G/H synthase 2 in chinese hamster ovary (CHO) cells				Bioorg Med Chem Lett 7: 57-62 (1997) Article DOI: 10.1016/S0960-894X(96)00582-3 BindingDB Entry DOI: 10.7270/Q29W0FG1
					More data for this Ligand-Target Pair