Reaction Details Report a problem with these data
Target
Sterol O-acyltransferase 1
Ligand
BDBM50038907
Substrate
n/a
Meas. Tech.
ChEMBL_28505 (CHEMBL645934)
IC50
21.7±n/a nM
Citation
 Tawada, H; Harcourt, M; Kawamura, N; Kajino, M; Ishikawa, E; Sugiyama, Y; Ikeda, H; Meguro, K Novel acyl-CoA:cholesterol acyltransferase inhibitors. Synthesis and biological activity of 3-quinolylurea derivatives. J Med Chem 37:2079-84 (1994) [PubMed]  Article 
Target
Name:
Sterol O-acyltransferase 1
Synonyms:
ACAT-1 | Acact | Acat | Cholesterol acyltransferase 1 | SOAT1_RAT | Soat1 | Sterol O-acyltransferase, Soat
Type:
PROTEIN
Mol. Mass.:
64165.56
Organism:
Rattus norvegicus
Description:
ChEMBL_28796
Residue:
545
Sequence:
MVGEETSLRNRLSRSAENPEQDEAQKNLLDTHRNGHITMKQLIAKKRQLAAEAEELKPLFLKEVGCHFDDFVTNLIDKSASLDNGGCALTTFSILEEMKNNHRAKDLRAPPEQGKIFISRRSLLDELFEVDHIRTIYHMFIALLIIFILSTLVVDYIDEGRLVLEFSLLAYAFGQFPIVIWTWWAMFLSTLAIPYFLFQRWAHGYSKSSHPLIYSLIHGAFFLVFQLGILGFIPTYVVLAYTLPPASRFILILEQIRLVMKAHSYVRENVPRVLSAAKEKSSTVPVPTVNQYLYFLFAPTLIYRDSYPRTPTVRWGYVAMQFLQVFGCLFYVYYIFERLCAPLFRNIKQEPFSARVLVLCVFNSILPGVLMLFLSFFAFLHCWLNAFAEMLRFGDRMFYKDWWNSTSYSNYYRTWNVVVHDWLYYYVYKDLLWFFSKRFRPAAMLAVFALSAVVHEYALAVCLSYFYPVLFVLFMFFGMAFNFIVNDSRKRPVWNIMVRASLFLGHGVILCFYSQEWYARQRCPLKNPTFLDYVRPRTWTCRYVF
  
Inhibitor
Name:
BDBM50038907
Synonyms:
1-(2,4-Difluoro-phenyl)-3-(6-methyl-4-o-tolyl-quinolin-3-yl)-urea | CHEMBL413330
Type:
Small organic molecule
Emp. Form.:
C24H19F2N3O
Mol. Mass.:
403.424
SMILES:
Cc1ccc2ncc(NC(=O)Nc3ccc(F)cc3F)c(-c3ccccc3C)c2c1 |(3.34,-3.16,;4.67,-2.39,;4.67,-.84,;6,-.05,;7.35,-.84,;8.66,-.05,;10.01,-.82,;10.02,-2.36,;11.35,-3.13,;12.68,-2.36,;12.68,-.82,;14.02,-3.13,;14.03,-4.67,;12.7,-5.44,;12.7,-6.98,;14.05,-7.73,;14.05,-9.27,;15.38,-6.95,;15.36,-5.42,;16.69,-4.63,;8.69,-3.15,;8.69,-4.69,;10.03,-5.44,;10.02,-6.98,;8.69,-7.75,;7.35,-6.98,;7.35,-5.44,;6.02,-4.67,;7.35,-2.38,;6.02,-3.13,)|
Structure:
Search PDB for entries with ligand similarity: