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BDBM50201913 2-(4-chlorophenyl)-3-hydroxy-6-(trifluoromethyl)quinoline-4-carboxylic acid::CHEMBL386700

SMILES: OC(=O)c1c(O)c(nc2ccc(cc12)C(F)(F)F)-c1ccc(Cl)cc1

InChI Key: InChIKey=VKXYBRPZHFQWGP-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 = 50201913   
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
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50201913
PNG
(2-(4-chlorophenyl)-3-hydroxy-6-(trifluoromethyl)qu...)
Show SMILES OC(=O)c1c(O)c(nc2ccc(cc12)C(F)(F)F)-c1ccc(Cl)cc1
Show InChI InChI=1S/C17H9ClF3NO3/c18-10-4-1-8(2-5-10)14-15(23)13(16(24)25)11-7-9(17(19,20)21)3-6-12(11)22-14/h1-7,23H,(H,24,25)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 270n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DHOD expressed in Escherichia coli


J Med Chem 50: 21-39 (2007)


Article DOI: 10.1021/jm0602256
BindingDB Entry DOI: 10.7270/Q2Z60PVV
More data for this
Ligand-Target Pair
P-selectin/P-selectin glycoprotein ligand 1


(Homo sapiens (Human))
BDBM50201913
PNG
(2-(4-chlorophenyl)-3-hydroxy-6-(trifluoromethyl)qu...)
Show SMILES OC(=O)c1c(O)c(nc2ccc(cc12)C(F)(F)F)-c1ccc(Cl)cc1
Show InChI InChI=1S/C17H9ClF3NO3/c18-10-4-1-8(2-5-10)14-15(23)13(16(24)25)11-7-9(17(19,20)21)3-6-12(11)22-14/h1-7,23H,(H,24,25)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60E+6n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of P-selectin-mediated adhesion of HL60 cells


J Med Chem 50: 21-39 (2007)


Article DOI: 10.1021/jm0602256
BindingDB Entry DOI: 10.7270/Q2Z60PVV
More data for this
Ligand-Target Pair