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Target
Diacylglycerol O-acyltransferase 1
Ligand
BDBM50020050
Substrate
n/a
Meas. Tech.
ChEMBL_1363772 (CHEMBL3294189)
IC50
37±n/a nM
Citation
 Zhou, G; Zorn, N; Ting, P; Aslanian, R; Lin, M; Cook, J; Lachowicz, J; Lin, A; Smith, M; Hwa, J; van Heek, M; Walker, S Development of novel benzomorpholine class of diacylglycerol acyltransferase I inhibitors. ACS Med Chem Lett 5:544-9 (2014) [PubMed]  Article 
Target
Name:
Diacylglycerol O-acyltransferase 1
Synonyms:
DGAT1_MOUSE | Dgat | Dgat1 | Diacyl Glycerolacyltransferase 1 (DGAT-1) | Diacylglycerol O-acyltransferase 1 (DGAT1) | Diglyceride acyltransferase
Type:
Enzyme
Mol. Mass.:
56810.61
Organism:
Mus musculus (mouse)
Description:
In this assay, recombinant mouse DGAT-1 containing an N-terminal His6-epitope tag was produced in the baculovirus expression system.
Residue:
498
Sequence:
MGDRGGAGSSRRRRTGSRVSVQGGSGPKVEEDEVRDAAVSPDLGAGGDAPAPAPAPAHTRDKDGRTSVGDGYWDLRCHRLQDSLFSSDSGFSNYRGILNWCVVMLILSNARLFLENLIKYGILVDPIQVVSLFLKDPYSWPAPCVIIASNIFVVAAFQIEKRLAVGALTEQMGLLLHVVNLATIICFPAAVALLVESITPVGSVFALASYSIMFLKLYSYRDVNLWCRQRRVKAKAVSTGKKVSGAAAQQAVSYPDNLTYRDLYYFIFAPTLCYELNFPRSPRIRKRFLLRRVLEMLFFTQLQVGLIQQWMVPTIQNSMKPFKDMDYSRIIERLLKLAVPNHLIWLIFFYWFFHSCLNAVAELLQFGDREFYRDWWNAESVTYFWQNWNIPVHKWCIRHFYKPMLRHGSSKWVARTGVFLTSAFFHEYLVSVPLRMFRLWAFTAMMAQVPLAWIVGRFFQGNYGNAAVWVTLIIGQPVAVLMYVHDYYVLNYDAPVGV
  
Inhibitor
Name:
BDBM50020050
Synonyms:
CHEMBL3287875
Type:
Small organic molecule
Emp. Form.:
C31H34N2O4
Mol. Mass.:
498.6127
SMILES:
CCc1ccccc1NC(=O)N1CCOc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 |r,wU:30.34,wD:27.30,(.52,-9.03,;2.06,-9.03,;2.83,-7.69,;2.06,-6.36,;2.83,-5.03,;4.37,-5.03,;5.14,-6.36,;4.37,-7.69,;5.14,-9.03,;6.68,-9.03,;7.45,-7.69,;7.45,-10.36,;6.68,-11.7,;7.45,-13.03,;8.99,-13.03,;9.76,-11.7,;11.3,-11.7,;12.07,-10.36,;11.3,-9.03,;9.76,-9.03,;8.99,-10.36,;13.61,-10.36,;14.38,-11.7,;15.92,-11.7,;16.69,-10.36,;15.92,-9.03,;14.38,-9.03,;18.23,-10.36,;19,-11.7,;20.54,-11.7,;21.31,-10.36,;22.85,-10.36,;23.62,-11.7,;25.16,-11.7,;22.85,-13.03,;20.54,-9.03,;19,-9.03,)|
Structure:
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