BDBM50229774 CHEMBL254418::N-Hydroxy-4-(5-methyl-3-phenylisoxazol-4-yl)benzenesulfonamide monohydrate::N-hydroxy-4-(5-methyl-3-phenylisoxazol-4-yl)benzenesulfonamide hydrate

SMILES: Cc1onc(c1-c1ccc(cc1)S(=O)(=O)NO)-c1ccccc1

InChI Key: InChIKey=ONTHNDYCEKOFIC-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50229774   

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
Cytochrome c oxidase subunit 2 (Homo sapiens (Human))	BDBM50229774 (CHEMBL254418 | N-Hydroxy-4-(5-methyl-3-phenylisoxa...) Show SMILES Cc1onc(c1-c1ccc(cc1)S(=O)(=O)NO)-c1ccccc1 Show InChI InChI=1S/C16H14N2O4S/c1-11-15(16(17-22-11)13-5-3-2-4-6-13)12-7-9-14(10-8-12)23(20,21)18-19/h2-10,18-19H,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc Curated by ChEMBL					Assay Description Inhibition of human recombinant cyclooxygenase 2				Bioorg Med Chem 16: 5322-30 (2008) Article DOI: 10.1016/j.bmc.2008.02.088 BindingDB Entry DOI: 10.7270/Q2FT8KS9
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase) (Ovis aries (Sheep))	BDBM50229774 (CHEMBL254418 | N-Hydroxy-4-(5-methyl-3-phenylisoxa...) Show SMILES Cc1onc(c1-c1ccc(cc1)S(=O)(=O)NO)-c1ccccc1 Show InChI InChI=1S/C16H14N2O4S/c1-11-15(16(17-22-11)13-5-3-2-4-6-13)12-7-9-14(10-8-12)23(20,21)18-19/h2-10,18-19H,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc Curated by ChEMBL					Assay Description Inhibition of ovine COX1				J Med Chem 51: 142-7 (2008) Article DOI: 10.1021/jm070821f BindingDB Entry DOI: 10.7270/Q20G3JWV
					More data for this Ligand-Target Pair
Cyclooxygenase (Homo sapiens (Human))	BDBM50229774 (CHEMBL254418 | N-Hydroxy-4-(5-methyl-3-phenylisoxa...) Show SMILES Cc1onc(c1-c1ccc(cc1)S(=O)(=O)NO)-c1ccccc1 Show InChI InChI=1S/C16H14N2O4S/c1-11-15(16(17-22-11)13-5-3-2-4-6-13)12-7-9-14(10-8-12)23(20,21)18-19/h2-10,18-19H,1H3	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	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc Curated by ChEMBL					Assay Description Inhibition of human recombinant COX2				J Med Chem 51: 142-7 (2008) Article DOI: 10.1021/jm070821f BindingDB Entry DOI: 10.7270/Q20G3JWV
					More data for this Ligand-Target Pair
Cytochrome c oxidase subunit 1 (Ovis aries)	BDBM50229774 (CHEMBL254418 | N-Hydroxy-4-(5-methyl-3-phenylisoxa...) Show SMILES Cc1onc(c1-c1ccc(cc1)S(=O)(=O)NO)-c1ccccc1 Show InChI InChI=1S/C16H14N2O4S/c1-11-15(16(17-22-11)13-5-3-2-4-6-13)12-7-9-14(10-8-12)23(20,21)18-19/h2-10,18-19H,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.57E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc Curated by ChEMBL					Assay Description Inhibition of ovine cyclooxygenase 1				Bioorg Med Chem 16: 5322-30 (2008) Article DOI: 10.1016/j.bmc.2008.02.088 BindingDB Entry DOI: 10.7270/Q2FT8KS9
					More data for this Ligand-Target Pair