BDBM50133024 3-Fluoro-4-[5-(4-methylsulfanyl-phenyl)-3-trifluoromethyl-pyrazol-1-yl]-benzenesulfonamide::CHEMBL339798

SMILES: CSc1ccc(cc1)-c1cc(nn1-c1ccc(cc1F)S(N)(=O)=O)C(F)(F)F

InChI Key: InChIKey=KUMPFBFGBNPMID-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 = 50133024   

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 (cyclooxygenase) (Ovis aries (Sheep))	BDBM50133024 (3-Fluoro-4-[5-(4-methylsulfanyl-phenyl)-3-trifluor...) Show SMILES CSc1ccc(cc1)-c1cc(nn1-c1ccc(cc1F)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H13F4N3O2S2/c1-27-11-4-2-10(3-5-11)15-9-16(17(19,20)21)23-24(15)14-7-6-12(8-13(14)18)28(22,25)26/h2-9H,1H3,(H2,22,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Dr Reddy's Laboratories Ltd. Curated by ChEMBL					Assay Description In vitro inhibition of the compound against Prostaglandin G/H synthase 1 from ram seminal vesicles				J Med Chem 46: 3975-84 (2003) Article DOI: 10.1021/jm020563g BindingDB Entry DOI: 10.7270/Q2HD7V29
					More data for this Ligand-Target Pair
Cyclooxygenase (Homo sapiens (Human))	BDBM50133024 (3-Fluoro-4-[5-(4-methylsulfanyl-phenyl)-3-trifluor...) Show SMILES CSc1ccc(cc1)-c1cc(nn1-c1ccc(cc1F)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H13F4N3O2S2/c1-27-11-4-2-10(3-5-11)15-9-16(17(19,20)21)23-24(15)14-7-6-12(8-13(14)18)28(22,25)26/h2-9H,1H3,(H2,22,25,26)	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	34	n/a	n/a	n/a	n/a	n/a	n/a
Dr Reddy's Laboratories Ltd. Curated by ChEMBL					Assay Description In vitro inhibition of the compound against human Prostaglandin G/H synthase 2				J Med Chem 46: 3975-84 (2003) Article DOI: 10.1021/jm020563g BindingDB Entry DOI: 10.7270/Q2HD7V29
					More data for this Ligand-Target Pair