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SMILES: CCCCCN(C)C(=O)Nc1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C

InChI Key: InChIKey=BQUFBLKXHOGXFE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50047503   
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)
BDBM50047503
PNG
(3-{2-Dimethylamino-6-[3-(4-phenyl-imidazol-1-yl)-p...)
Show SMILES CCCCCN(C)C(=O)Nc1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C
Show InChI InChI=1S/C27H37N5O2/c1-5-6-10-17-31(4)27(33)29-26-24(30(2)3)15-11-16-25(26)34-19-12-18-32-20-23(28-21-32)22-13-8-7-9-14-22/h7-9,11,13-16,20-21H,5-6,10,12,17-19H2,1-4H3,(H,29,33)
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UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 280n/an/an/an/an/an/a



Eisai Company, Ltd.

Curated by ChEMBL


Assay Description
Tested for inhibition against acyl coenzyme A:cholesterol acyltransferase from rabbit aorta homogenate.


J Med Chem 36: 1630-40 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X4P
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50047503
PNG
(3-{2-Dimethylamino-6-[3-(4-phenyl-imidazol-1-yl)-p...)
Show SMILES CCCCCN(C)C(=O)Nc1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C
Show InChI InChI=1S/C27H37N5O2/c1-5-6-10-17-31(4)27(33)29-26-24(30(2)3)15-11-16-25(26)34-19-12-18-32-20-23(28-21-32)22-13-8-7-9-14-22/h7-9,11,13-16,20-21H,5-6,10,12,17-19H2,1-4H3,(H,29,33)
PDB

Reactome pathway
KEGG

UniProtKB/TrEMBL

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 550n/an/an/an/an/an/a



Eisai Company, Ltd.

Curated by ChEMBL


Assay Description
Tested for inhibition against acyl coenzyme A:cholesterol acyltransferase from rabbit aorta homogenate.


J Med Chem 36: 1630-40 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X4P
More data for this
Ligand-Target Pair