Reaction Details | |||
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Target | Acetyl-CoA carboxylase 2 | ||
Ligand | BDBM50350752 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_762997 (CHEMBL1820814) | ||
IC50 | 680±n/a nM | ||
Citation | Bengtsson, C; Blaho, S; Saitton, DB; Brickmann, K; Broddefalk, J; Davidsson, O; Drmota, T; Folmer, R; Hallberg, K; Hallén, S; Hovland, R; Isin, E; Johannesson, P; Kull, B; Larsson, LO; Löfgren, L; Nilsson, KE; Noeske, T; Oakes, N; Plowright, AT; Schnecke, V; Ståhlberg, P; Sörme, P; Wan, H; Wellner, E; Oster, L Design of small molecule inhibitors of acetyl-CoA carboxylase 1 and 2 showing reduction of hepatic malonyl-CoA levels in vivo in obese Zucker rats. Bioorg Med Chem19:3039-53 (2011) [PubMed] Article | ||
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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BDBM50350752 | |||
n/a | |||
Name | BDBM50350752 | ||
Synonyms: | CHEMBL1818302 | ||
Type | Small organic molecule | ||
Emp. Form. | C33H49N5O4 | ||
Mol. Mass. | 579.7733 | ||
SMILES | CN(C)CCC1CCN(CC1)c1cc(C(=O)NC[C@H]2CC[C@H](CNC(=O)OC3CCOCC3)CC2)c2ccccc2n1 |r,wU:21.22,wD:18.18,(33.6,-14.34,;33.6,-12.8,;34.93,-12.03,;32.26,-12.03,;32.26,-10.49,;30.93,-9.72,;29.59,-10.48,;28.26,-9.72,;28.27,-8.19,;29.59,-7.4,;30.93,-8.17,;26.93,-7.42,;26.92,-5.87,;25.59,-5.11,;25.58,-3.57,;26.91,-2.8,;24.24,-2.81,;24.23,-1.27,;22.9,-.51,;22.89,1.04,;21.56,1.8,;20.22,1.03,;18.89,1.8,;18.89,3.34,;17.55,4.11,;17.55,5.65,;16.22,3.34,;14.88,4.1,;14.89,5.65,;13.56,6.41,;12.22,5.65,;12.22,4.11,;13.56,3.33,;20.23,-.51,;21.57,-1.28,;24.26,-5.88,;22.93,-5.12,;21.6,-5.89,;21.6,-7.43,;22.93,-8.21,;24.26,-7.43,;25.6,-8.19,)| | ||
Structure |