Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Melanocortin receptor 4 | ||
Ligand | BDBM50217686 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_448693 (CHEMBL897839) | ||
Ki | 1600±n/a nM | ||
Citation | Mutulis, F; Kreicberga, J; Yahorava, S; Mutule, I; Borisova-Jan, L; Yahorau, A; Muceniece, R; Azena, S; Veiksina, S; Petrovska, R; Wikberg, JE Design and synthesis of a library of tertiary amides: evaluation as mimetics of the melanocortins' active core. Bioorg Med Chem15:5787-810 (2007) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Melanocortin receptor 4 | |||
Name: | Melanocortin receptor 4 | ||
Synonyms: | MC4-R | MC4R | MC4R_HUMAN | Melanocortin MC4 | Melanocortin receptor 4 (MC-4) | Melanocortin receptor 4 (MC4-R) | Melanocortin receptor 4 (MC4R) | ||
Type: | Enzyme | ||
Mol. Mass.: | 36949.50 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P32245 | ||
Residue: | 332 | ||
Sequence: |
| ||
BDBM50217686 | |||
n/a | |||
Name | BDBM50217686 | ||
Synonyms: | CHEMBL399810 | N-(4-cyanobenzyl)-N-(4-((4-aminocyclohexyl)methyl)cyclohexyl)-4-(1H-indol-3-yl)butanamide | ||
Type | Small organic molecule | ||
Emp. Form. | C33H42N4O | ||
Mol. Mass. | 510.7128 | ||
SMILES | NC1CCC(CC2CCC(CC2)N(Cc2ccc(cc2)C#N)C(=O)CCCc2c[nH]c3ccccc23)CC1 |(23.5,-13.29,;22.17,-14.06,;22.18,-15.6,;20.86,-16.39,;19.51,-15.62,;18.19,-16.4,;18.21,-17.94,;19.56,-18.71,;19.58,-20.26,;18.24,-21.05,;16.88,-20.3,;16.87,-18.74,;18.27,-22.61,;16.95,-23.4,;15.6,-22.65,;15.67,-21.11,;14.37,-20.29,;13,-21,;12.95,-22.55,;14.25,-23.37,;11.7,-20.18,;10.4,-19.36,;19.62,-23.37,;19.65,-24.92,;20.95,-22.57,;22.29,-23.3,;23.63,-22.53,;24.95,-23.29,;26.36,-22.62,;27.42,-23.75,;26.67,-25.1,;27.16,-26.54,;26.16,-27.7,;24.64,-27.4,;24.15,-25.95,;25.16,-24.79,;19.5,-14.09,;20.83,-13.31,)| | ||
Structure |