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BDBM50022556 2-Dichloromethyl-4-hydroxy-8-trifluoromethyl-quinoline-3-carboxylic acid thiazol-2-ylamide::CHEMBL285278

SMILES: Oc1c(C(=O)Nc2nccs2)c(nc2c(cccc12)C(F)(F)F)C(Cl)Cl

InChI Key: InChIKey=GLLLSFSHYFLEMU-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50022556   
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


(Bos taurus)
BDBM50022556
PNG
(2-Dichloromethyl-4-hydroxy-8-trifluoromethyl-quino...)
Show SMILES Oc1c(C(=O)Nc2nccs2)c(nc2c(cccc12)C(F)(F)F)C(Cl)Cl
Show InChI InChI=1S/C15H8Cl2F3N3O2S/c16-12(17)10-8(13(25)23-14-21-4-5-26-14)11(24)6-2-1-3-7(9(6)22-10)15(18,19)20/h1-5,12H,(H,22,24)(H,21,23,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



Centre de Recherches Roussel Uclaf

Curated by ChEMBL


Assay Description
Inhibition of bovine Prostaglandin G/H synthase after oral administration


J Med Chem 31: 1453-62 (1988)


BindingDB Entry DOI: 10.7270/Q2JM2B7T
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50022556
PNG
(2-Dichloromethyl-4-hydroxy-8-trifluoromethyl-quino...)
Show SMILES Oc1c(C(=O)Nc2nccs2)c(nc2c(cccc12)C(F)(F)F)C(Cl)Cl
Show InChI InChI=1S/C15H8Cl2F3N3O2S/c16-12(17)10-8(13(25)23-14-21-4-5-26-14)11(24)6-2-1-3-7(9(6)22-10)15(18,19)20/h1-5,12H,(H,22,24)(H,21,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Centre de Recherches Roussel Uclaf

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from rat peritoneal neutrophils after oral administration


J Med Chem 31: 1453-62 (1988)


BindingDB Entry DOI: 10.7270/Q2JM2B7T
More data for this
Ligand-Target Pair