Reaction Details Report a problem with these data
Target
Melanocortin receptor 4
Ligand
BDBM50252902
Substrate
n/a
Meas. Tech.
ChEMBL_539392 (CHEMBL1027276)
Ki
19±n/a nM
Citation
 Proneth, B; Pogozheva, ID; Portillo, FP; Mosberg, HI; Haskell-Luevano, C Melanocortin tetrapeptide Ac-His-DPhe-Arg-Trp-NH2 modified at the para position of the benzyl side chain (DPhe): importance for mouse melanocortin-3 receptor agonist versus antagonist activity. J Med Chem 51:5585-93 (2008) [PubMed]  Article 
Target
Name:
Melanocortin receptor 4
Synonyms:
MC4-R | MC4R_MOUSE | Mc4r
Type:
PROTEIN
Mol. Mass.:
36964.43
Organism:
Mus musculus
Description:
ChEMBL_1498850
Residue:
332
Sequence:
MNSTHHHGMYTSLHLWNRSSYGLHGNASESLGKGHPDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVRRVGIIISCIWAACTVSGVLFIIYSDSSAVIICLISMFFTMLVLMASLYVHMFLMARLHIKRIAVLPGTGTIRQGTNMKGAITLTILIGVFVVCWAPFFLHLLFYISCPQNPYCVCFMSHFNLYLILIMCNAVIDPLIYALRSQELRKTFKEIICFYPLGGICELSSRY
  
Inhibitor
Name:
BDBM50252902
Synonyms:
Ac-His-DNal(2)-Arg-Trp-NH2 | CHEMBL454736
Type:
Small organic molecule
Emp. Form.:
C38H45N11O5
Mol. Mass.:
735.8346
SMILES:
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r,wU:4.3,29.31,wD:14.14,40.42,(4.17,-10.81,;2.84,-10.04,;2.84,-8.5,;1.5,-10.81,;1.5,-12.35,;.17,-13.12,;-1.16,-12.35,;-1.31,-10.85,;-2.79,-10.52,;-3.53,-11.84,;-2.51,-12.96,;2.84,-13.12,;2.84,-14.66,;4.17,-12.35,;5.5,-13.12,;5.5,-14.66,;6.83,-15.42,;8.16,-14.65,;9.48,-15.41,;9.48,-16.95,;10.82,-17.73,;10.82,-19.27,;9.46,-20.04,;8.14,-19.26,;8.14,-17.72,;6.82,-16.95,;6.83,-12.35,;6.83,-10.81,;8.17,-13.1,;9.51,-12.34,;9.51,-10.8,;10.84,-10.03,;10.84,-8.49,;12.17,-7.72,;12.17,-6.18,;10.85,-5.4,;13.5,-5.41,;10.84,-13.1,;10.84,-14.64,;12.17,-12.33,;13.5,-13.11,;13.5,-14.65,;14.84,-15.42,;16.27,-14.7,;17.32,-15.82,;16.59,-17.17,;17.09,-18.64,;16.08,-19.79,;14.56,-19.51,;14.06,-18.04,;15.07,-16.88,;14.84,-12.34,;16.17,-13.11,;14.84,-10.8,)|
Structure:
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