BDBM50173290 4-[5-(2-Fluoro-ethyl)-3-phenyl-isoxazol-4-yl]-benzenesulfonamide::CHEMBL196041

SMILES: NS(=O)(=O)c1ccc(cc1)-c1c(CCF)onc1-c1ccccc1

InChI Key: InChIKey=FUDHASBGRVLGEV-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 = 50173290   

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))	BDBM50173290 (4-[5-(2-Fluoro-ethyl)-3-phenyl-isoxazol-4-yl]-benz...) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1c(CCF)onc1-c1ccccc1 Show InChI InChI=1S/C17H15FN2O3S/c18-11-10-15-16(12-6-8-14(9-7-12)24(19,21)22)17(20-23-15)13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,19,21,22)	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	8	n/a	n/a	n/a	n/a	n/a	n/a
David Geffen School of Medicine at University of California Curated by ChEMBL					Assay Description Inhibitory activity against human recombinant cyclooxygenase 2				Bioorg Med Chem Lett 15: 4699-702 (2005) Article DOI: 10.1016/j.bmcl.2005.07.065 BindingDB Entry DOI: 10.7270/Q2H131KS
					More data for this Ligand-Target Pair
Cyclooxygenase-2 (COX-2) (Mus musculus (Mouse))	BDBM50173290 (4-[5-(2-Fluoro-ethyl)-3-phenyl-isoxazol-4-yl]-benz...) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1c(CCF)onc1-c1ccccc1 Show InChI InChI=1S/C17H15FN2O3S/c18-11-10-15-16(12-6-8-14(9-7-12)24(19,21)22)17(20-23-15)13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,19,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
David Geffen School of Medicine at University of California Curated by ChEMBL					Assay Description Tested for prostaglandin E2 production as a function of COX-2 inhibition using endotoxin-treated murine RAW 264.7 macrophages				Bioorg Med Chem Lett 15: 4699-702 (2005) Article DOI: 10.1016/j.bmcl.2005.07.065 BindingDB Entry DOI: 10.7270/Q2H131KS
					More data for this Ligand-Target Pair