Reaction Details Report a problem with these data
Target
Choline/ethanolaminephosphotransferase 1
Ligand
BDBM50481335
Substrate
n/a
Meas. Tech.
ChEMBL_606314 (CHEMBL1070006)
IC50
200±n/a nM
Citation
 Smith, CJ; Ali, A; Chen, L; Hammond, ML; Anderson, MS; Chen, Y; Eveland, SS; Guo, Q; Hyland, SA; Milot, DP; Sparrow, CP; Wright, SD; Sinclair, PJ 2-Arylbenzoxazoles as CETP inhibitors: Substitution of the benzoxazole moiety. Bioorg Med Chem Lett 20:346-9 (2010) [PubMed]  Article 
Target
Name:
Choline/ethanolaminephosphotransferase 1
Synonyms:
2.7.8.1 | 2.7.8.2 | CEPT1 | CEPT1_HUMAN | Choline/ethanolaminephosphotransferase 1 | hCEPT1
Type:
PROTEIN
Mol. Mass.:
46568.68
Organism:
Homo sapiens
Description:
ChEMBL_117345
Residue:
416
Sequence:
MSGHRSTRKRCGDSHPESPVGFGHMSTTGCVLNKLFQLPTPPLSRHQLKRLEEHRYQSAGRSLLEPLMQGYWEWLVRRVPSWIAPNLITIIGLSINICTTILLVFYCPTATEQAPLWAYIACACGLFIYQSLDAIDGKQARRTNSSSPLGELFDHGCDSLSTVFVVLGTCIAVQLGTNPDWMFFCCFAGTFMFYCAHWQTYVSGTLRFGIIDVTEVQIFIIIMHLLAVIGGPPFWQSMIPVLNIQMKIFPALCTVAGTIFSCTNYFRVIFTGGVGKNGSTIAGTSVLSPFLHIGSVITLAAMIYKKSAVQLFEKHPCLYILTFGFVSAKITNKLVVAHMTKSEMHLHDTAFIGPALLFLDQYFNSFIDEYIVLWIALVFSFFDLIRYCVSVCNQIASHLHIHVFRIKVSTAHSNHH
  
Inhibitor
Name:
BDBM50481335
Synonyms:
CHEMBL594183
Type:
Small organic molecule
Emp. Form.:
C27H27BrN2O4
Mol. Mass.:
523.418
SMILES:
CCCC(C)(O)c1cc(Br)cc2nc(oc12)-c1ccc(NC(=O)COc2ccccc2C)cc1
Structure:
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