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BDBM50057929 4-[2-(4-Chloro-phenyl)-4-trifluoromethyl-imidazol-1-yl]-benzenesulfonamide::CHEMBL45192

SMILES: NS(=O)(=O)c1ccc(cc1)-n1cc(nc1-c1ccc(Cl)cc1)C(F)(F)F

InChI Key: InChIKey=ZINNGAUEQDMHNV-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 = 50057929   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cyclooxygenase-1 (COX-1)


(Homo sapiens (Human))
BDBM50057929
PNG
(4-[2-(4-Chloro-phenyl)-4-trifluoromethyl-imidazol-...)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(nc1-c1ccc(Cl)cc1)C(F)(F)F
Show InChI InChI=1S/C16H11ClF3N3O2S/c17-11-3-1-10(2-4-11)15-22-14(16(18,19)20)9-23(15)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Searle Research and Development

Curated by ChEMBL


Assay Description
Concentration required to inhibit human prostaglandin G/H synthase 1 (COX-1) by 50%


J Med Chem 40: 1634-47 (1997)


Article DOI: 10.1021/jm9700225
BindingDB Entry DOI: 10.7270/Q2F76BN0
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Mus musculus (Mouse))
BDBM50057929
PNG
(4-[2-(4-Chloro-phenyl)-4-trifluoromethyl-imidazol-...)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(nc1-c1ccc(Cl)cc1)C(F)(F)F
Show InChI InChI=1S/C16H11ClF3N3O2S/c17-11-3-1-10(2-4-11)15-22-14(16(18,19)20)9-23(15)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 10n/an/an/an/an/an/a



University of Hyderabad

Curated by ChEMBL


Assay Description
Inhibitory activity against prostaglandin G/H synthase 2 (COX-2)


J Med Chem 45: 4847-57 (2002)


BindingDB Entry DOI: 10.7270/Q2SX6FFJ
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM50057929
PNG
(4-[2-(4-Chloro-phenyl)-4-trifluoromethyl-imidazol-...)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(nc1-c1ccc(Cl)cc1)C(F)(F)F
Show InChI InChI=1S/C16H11ClF3N3O2S/c17-11-3-1-10(2-4-11)15-22-14(16(18,19)20)9-23(15)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)
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/an/a 10n/an/an/an/an/an/a



Universit£ de Lille 2

Curated by ChEMBL


Assay Description
Inhibition of human Prostaglandin G/H synthase 2


J Med Chem 44: 3223-30 (2001)


BindingDB Entry DOI: 10.7270/Q2736S4D
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM50057929
PNG
(4-[2-(4-Chloro-phenyl)-4-trifluoromethyl-imidazol-...)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(nc1-c1ccc(Cl)cc1)C(F)(F)F
Show InChI InChI=1S/C16H11ClF3N3O2S/c17-11-3-1-10(2-4-11)15-22-14(16(18,19)20)9-23(15)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Searle Research and Development

Curated by ChEMBL


Assay Description
Concentration required to inhibit human Prostaglandin G/H synthase 2 (COX-2) by 50%


J Med Chem 40: 1634-47 (1997)


Article DOI: 10.1021/jm9700225
BindingDB Entry DOI: 10.7270/Q2F76BN0
More data for this
Ligand-Target Pair