BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAcyl coenzyme A:cholesterol acyltransferase 1
LigandBDBM50450346
Substrate/Competitorn/a
Meas. Tech.ChEBML_28026
IC50 10±n/a nM
Citation Wilde, RGBillheimer, JT Acyl CoA:cholesterol acyltransferase (ACAT) inhibitors: ureas bearing two heterocyclic head groups Bioorg Med Chem Lett5:173-6 (1995)  
More Info.:Get all data from this article,  Assay Method
 
Acyl coenzyme A:cholesterol acyltransferase 1
Name:Acyl coenzyme A:cholesterol acyltransferase 1
Synonyms:ACAT-1 | Acetoacetyl-CoA thiolase | Acetyl-CoA acetyltransferase, mitochondrial | Acyl-coenzyme A:cholesterol acyltransferase 1 | Cholesterol acyltransferase 1 | Sterol O-acyltransferase 1
Type:PROTEIN
Mol. Mass.:63818.83
Organism:Mus musculus
Description:ChEMBL_90523
Residue:540
Sequence:
MSLRNRLSKSGENPEQDEAQKNFMDTYRNGHITMKQLIAKKRLLAAEAEELKPLFMKEVG
CHFDDFVTNLIEKSASLDNGGCALTTFSILEEMKKNHRAKDLRAPPEQGKIFISRQSLLD
ELFEVDHIRTIYHMFIALLILFVLSTIVVDYIDEGRLVLEFNLLAYAFGKFPTVIWTWWA
MFLSTLSIPYFLFQRWAHGYSKSSHPLIYSLVHGLLFLVFQLGVLGFVPTYVVLAYTLPP
ASRFILILEQIRLIMKAHSFVRENIPRVLNAAKEKSSKDPLPTVNQYLYFLFAPTLIYRD
NYPRTPTVRWGYVAMQFLQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCVFNSI
LPGVLILFLSFFAFLHCWLNAFAEMLRFGDRMFYKDWWNSTSYSNYYRTWNVVVHDWLYY
YVYKDLLWFFSKRFKSAAMLAVFALSAVVHEYALAICLSYFYPVLFVLFMFFGMAFNFIV
NDSRKRPIWNIMVWASLFLGYGLILCFYSQEWYARQHCPLKNPTFLDYVRPRTWTCRYVF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50450346
NameBDBM50450346
Synonyms:CHEMBL300883
TypeSmall organic molecule
Emp. Form.C48H58N6O5S2
Mol. Mass.863.141
SMILESCOc1ccc(cc1)-c1nc(SCCCCCN(CCCCCSc2nc(c([nH]2)-c2ccc(OC)cc2)-c2ccc(OC)cc2)C(=O)NC(C)C)[nH]c1-c1ccc(OC)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a