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Target
Diacylglycerol O-acyltransferase 1
Ligand
BDBM209534
Substrate
n/a
Meas. Tech.
Inhibition Assay
pH
7.4±n/a
Temperature
298.15±n/a K
IC50
7.6±n/a nM
Comments
extracted
Citation
 Kim, D; Bok, J; Shin, S Compounds as inhibitors of diacylglycerol O-acyltransferase type 1 enzyme US Patent  US9271969 Publication Date 3/1/2016 
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:
BDBM209534
Synonyms:
US9271969, 22
Type:
Small organic molecule
Emp. Form.:
C30H30ClN3O3
Mol. Mass.:
516.031
SMILES:
Cc1cccc(Cl)c1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 |r,wD:30.34,(-10.83,2.41,;-10.06,3.75,;-10.83,5.08,;-10.06,6.41,;-8.52,6.41,;-7.75,5.08,;-6.21,5.08,;-8.52,3.75,;-7.75,2.41,;-8.52,1.08,;-7.75,-.25,;-8.52,-1.59,;-6.21,-.25,;-5.3,-1.5,;-3.84,-1.02,;-2.51,-1.79,;-1.17,-1.02,;-1.17,.52,;-2.51,1.29,;-3.84,.52,;-5.3,.99,;.16,-1.79,;.16,-3.33,;1.49,-4.1,;2.83,-3.33,;2.83,-1.79,;1.49,-1.02,;4.16,-4.1,;5.5,-3.33,;6.83,-4.1,;6.83,-5.64,;8.16,-6.41,;9.5,-5.64,;10.83,-6.41,;9.5,-4.1,;5.5,-6.41,;4.16,-5.64,)|
Structure:
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