BindingDB logo
myBDB logout

BDBM50454989 CHEMBL78597

SMILES: Cc1cc(C)c(NC(=O)N(Cc2ccc(cc2)-c2cnn(C)c2)C2CCCCCC2)c(C)c1

InChI Key: InChIKey=YZHVDVMPAFWSQJ-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 = 50454989   
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
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50454989
PNG
(CHEMBL78597)
Show SMILES Cc1cc(C)c(NC(=O)N(Cc2ccc(cc2)-c2cnn(C)c2)C2CCCCCC2)c(C)c1
Show InChI InChI=1S/C28H36N4O/c1-20-15-21(2)27(22(3)16-20)30-28(33)32(26-9-7-5-6-8-10-26)18-23-11-13-24(14-12-23)25-17-29-31(4)19-25/h11-17,19,26H,5-10,18H2,1-4H3,(H,30,33)
PDB

Reactome pathway
KEGG

UniProtKB/TrEMBL

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 47n/an/an/an/an/an/a



Fujisawa Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase (ACAT) in rabbit intestinal microsomes


J Med Chem 41: 2390-410 (1998)


Article DOI: 10.1021/jm9800853
BindingDB Entry DOI: 10.7270/Q2MW2G7V
More data for this
Ligand-Target Pair