Reaction Details | |||
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Target | Acetyl-CoA carboxylase 2 | ||
Ligand | BDBM369687 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | The Measurement of Inhibitory Activity on Human ACC1 and the ACC2 | ||
IC50 | 44.0±n/a nM | ||
Citation | Ohyabu, N; Kurahashi, K; Nishiura, Y; Katou, M; Miyazaki, K; Sasaki, Y; Wada, T; Iwatsu, M 9-membered fused ring derivative US Patent US10233156 Publication Date 3/19/2019 | ||
More Info.: | Get all data from this article, Assay Method | ||
Acetyl-CoA carboxylase 2 | |||
Name: | Acetyl-CoA carboxylase 2 | ||
Synonyms: | ACACB | ACACB_HUMAN | ACC-beta | ACC2 | ACCB | Acetyl-CoA carboxylase | Acetyl-CoA carboxylase 2 | Acetyl-CoA carboxylase 2 (ACC) | Acetyl-CoA carboxylase 2 (ACC2) | ||
Type: | Protein | ||
Mol. Mass.: | 276535.21 | ||
Organism: | Homo sapiens (Human) | ||
Description: | O00763 | ||
Residue: | 2458 | ||
Sequence: |
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BDBM369687 | |||
n/a | |||
Name | BDBM369687 | ||
Synonyms: | US10233156, Example I-227 | ||
Type | Small organic molecule | ||
Emp. Form. | C22H25F5N4O4 | ||
Mol. Mass. | 504.4503 | ||
SMILES | Cn1c(O[C@H]2CC[C@@H](CC2)OC[C@H](CF)NC(=O)CC#N)nc2c(F)cc(OCC(F)F)c(F)c12 |r,wU:7.10,12.15,wD:4.3,(-5.12,3.37,;-4.73,1.88,;-3.32,1.25,;-1.98,2.02,;-.65,1.25,;-.65,-.29,;.68,-1.06,;2.02,-.29,;2.02,1.25,;.68,2.02,;3.35,-1.06,;4.68,-.29,;6.02,-1.06,;6.02,-2.6,;4.68,-3.37,;7.35,-.29,;8.68,-1.06,;8.68,-2.6,;10.02,-.29,;11.35,-1.06,;12.69,-1.83,;-3.48,-.28,;-4.99,-.6,;-5.76,-1.93,;-4.99,-3.27,;-7.3,-1.93,;-8.07,-.6,;-9.61,-.6,;-10.38,-1.93,;-11.92,-1.93,;-12.69,-3.27,;-12.69,-.6,;-7.3,.73,;-8.07,2.07,;-5.76,.73,)| | ||
Structure |