Reaction Details | |||
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Target | Acetyl-CoA carboxylase 2 | ||
Ligand | BDBM50350731 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_762997 (CHEMBL1820814) | ||
IC50 | 690±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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BDBM50350731 | |||
n/a | |||
Name | BDBM50350731 | ||
Synonyms: | CHEMBL1818186 | ||
Type | Small organic molecule | ||
Emp. Form. | C28H35N3O4S | ||
Mol. Mass. | 509.66 | ||
SMILES | CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNS(=O)(=O)c2cc(nc3ccccc23)-c2ccccc2)CC1 |r,wU:9.8,wD:12.12,(22.76,4.28,;24.1,5.06,;24.09,6.6,;22.76,5.83,;25.43,4.29,;26.77,5.07,;26.76,6.61,;28.1,4.3,;28.11,2.76,;29.44,1.99,;30.77,2.77,;32.1,1.99,;32.1,.45,;33.44,-.32,;33.44,-1.86,;34.77,-2.63,;35.16,-1.14,;36.25,-3.02,;34.77,-4.18,;36.1,-4.94,;36.1,-6.48,;34.76,-7.25,;33.43,-6.48,;32.1,-7.24,;30.78,-6.47,;30.78,-4.93,;32.11,-4.17,;33.44,-4.94,;37.43,-7.24,;37.43,-8.78,;38.77,-9.55,;40.1,-8.78,;40.09,-7.23,;38.76,-6.47,;30.77,-.31,;29.44,.45,)| | ||
Structure |