Reaction Details | |||
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Target | Melanocyte-stimulating hormone receptor | ||
Ligand | BDBM50191551 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_376971 (CHEMBL853374) | ||
Ki | 15±n/a nM | ||
Citation | Tian, X; Field, TB; Switzer, AG; Mazur, AW; Ebetino, FH; Wos, JA; Berberich, SM; Jayasinghe, LR; Obringer, CM; Dowty, ME; Pinney, BB; Farmer, JA; Crossdoersen, D; Sheldon, RJ Design, synthesis, and evaluation of proline and pyrrolidine based melanocortin receptor agonists. A conformationally restricted dipeptide mimic approach. J Med Chem49:4745-61 (2006) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Melanocyte-stimulating hormone receptor | |||
Name: | Melanocyte-stimulating hormone receptor | ||
Synonyms: | MC1-R | MC1R | MSH-R | MSHR | MSHR_HUMAN | Melanocortin MC1 | Melanocortin receptor (M1 and M4) | Melanocortin receptor 1 (MC-1) | Melanocortin receptor 1 (MC1-R) | Melanocortin receptor 1 (MC1R) | ||
Type: | Enzyme | ||
Mol. Mass.: | 34717.23 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q01726 | ||
Residue: | 317 | ||
Sequence: |
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BDBM50191551 | |||
n/a | |||
Name | BDBM50191551 | ||
Synonyms: | (2R,4R)-1-((R)-2-((S)-2-amino-3-(1H-imidazol-4-yl)propanamido)-3-phenylpropanoyl)-N-(2-guanidinoethyl)-4-(naphthalen-2-ylmethoxy)pyrrolidine-2-carboxamide | CHEMBL209587 | ||
Type | Small organic molecule | ||
Emp. Form. | C34H41N9O4 | ||
Mol. Mass. | 639.7472 | ||
SMILES | N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C[C@@H]1C(=O)NCCN=C(N)N)OCc1ccc2ccccc2c1 |wU:25.28,11.11,23.37,wD:1.0,(15.6,-11.59,;14.27,-12.36,;12.94,-11.59,;12.94,-10.05,;11.68,-9.15,;12.16,-7.69,;13.7,-7.69,;14.17,-9.15,;14.27,-13.9,;15.61,-14.67,;12.94,-14.67,;12.94,-16.21,;11.61,-16.99,;10.27,-16.22,;8.93,-16.99,;7.6,-16.22,;7.6,-14.67,;8.93,-13.9,;10.27,-14.67,;14.28,-16.98,;15.61,-16.21,;14.28,-18.52,;13.03,-19.43,;13.51,-20.89,;15.05,-20.89,;15.52,-19.43,;16.87,-18.68,;16.89,-17.14,;18.19,-19.47,;19.54,-18.72,;20.86,-19.51,;22.2,-18.76,;23.52,-19.56,;24.87,-18.81,;23.5,-21.1,;12.6,-22.14,;13.23,-23.55,;12.47,-24.88,;13.24,-26.21,;12.48,-27.54,;10.93,-27.55,;10.17,-28.87,;8.64,-28.88,;7.87,-27.55,;8.63,-26.22,;10.17,-26.22,;10.92,-24.88,)| | ||
Structure |