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BDBM50141585 4-(3-Chloro-4-methoxy-benzylamino)-6-trifluoromethyl-quinoline-3-carboxylic acid ethyl ester::CHEMBL42869

SMILES: CCOC(=O)c1cnc2ccc(cc2c1NCc1ccc(OC)c(Cl)c1)C(F)(F)F

InChI Key: InChIKey=KVNCMWLMNCGOGL-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50141585   
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
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50141585
PNG
(4-(3-Chloro-4-methoxy-benzylamino)-6-trifluorometh...)
Show SMILES CCOC(=O)c1cnc2ccc(cc2c1NCc1ccc(OC)c(Cl)c1)C(F)(F)F
Show InChI InChI=1S/C21H18ClF3N2O3/c1-3-30-20(28)15-11-26-17-6-5-13(21(23,24)25)9-14(17)19(15)27-10-12-4-7-18(29-2)16(22)8-12/h4-9,11H,3,10H2,1-2H3,(H,26,27)
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MMDB

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Similars

Article
PubMed
n/an/a 73n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of phosphodiesterase 5 from human platelets


Bioorg Med Chem Lett 14: 1577-80 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.090
BindingDB Entry DOI: 10.7270/Q2G1607Q
More data for this
Ligand-Target Pair