BindingDB logo
myBDB logout

BDBM50481327 CHEMBL605743

SMILES: Cc1ccccc1OCC(=O)Nc1ccc(cc1)-c1nc2cc(Cl)c(C)cc2o1

InChI Key: InChIKey=CWLVQDVTYUTHEY-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50481327   
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
Choline/ethanolaminephosphotransferase 1


(Homo sapiens)
BDBM50481327
PNG
(CHEMBL605743)
Show SMILES Cc1ccccc1OCC(=O)Nc1ccc(cc1)-c1nc2cc(Cl)c(C)cc2o1
Show InChI InChI=1S/C23H19ClN2O3/c1-14-5-3-4-6-20(14)28-13-22(27)25-17-9-7-16(8-10-17)23-26-19-12-18(24)15(2)11-21(19)29-23/h3-12H,13H2,1-2H3,(H,25,27)
UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
inhibition of human CEPT assessed as cholesteryl ester transfer by fluorescence transfer assay


Bioorg Med Chem Lett 20: 346-9 (2010)


Article DOI: 10.1016/j.bmcl.2009.10.099
BindingDB Entry DOI: 10.7270/Q2FJ2KKK
More data for this
Ligand-Target Pair