Reaction Details Report a problem with these data
Target
Melanocortin receptor 4
Ligand
BDBM50301149
Substrate
n/a
Meas. Tech.
ChEMBL_598565 (CHEMBL1043557)
EC50
22750±n/a nM
Citation
 Ruwe, AR; Koikov, L; Abdel-Malek, Z; Haskell-Luevano, C; Dirain, ML; Portillo, F; Xiang, Z; Wortman, M; Knittel, JJ Semi-rigid tripeptide agonists of melanocortin receptors. Bioorg Med Chem Lett 19:5176-81 (2009) [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:
BDBM50301149
Synonyms:
(S)-2-((R)-2-((S)-3-(1H-imidazol-5-yl)-2-(4-oxo-4-phenylbutanamido)propanamido)-3-phenylpropanamido)-5-guanidinopentanamide | CHEMBL569221
Type:
Small organic molecule
Emp. Form.:
C31H39N9O5
Mol. Mass.:
617.6987
SMILES:
NC(N)=NCCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCC(=O)c1ccccc1)C(N)=O |r,wU:22.30,7.7,wD:11.19,(33.24,-4.13,;31.9,-3.38,;31.91,-1.83,;30.56,-4.14,;29.22,-3.39,;27.89,-4.15,;26.56,-3.39,;26.56,-1.85,;25.22,-1.07,;23.89,-1.84,;23.89,-3.38,;22.56,-1.07,;22.56,.47,;21.22,1.24,;21.22,2.78,;19.89,3.55,;18.56,2.78,;18.56,1.24,;19.89,.47,;21.23,-1.84,;21.24,-3.38,;22.57,-4.15,;19.91,-4.15,;18.57,-3.38,;17.24,-4.15,;15.84,-3.52,;14.8,-4.67,;15.57,-6,;17.08,-5.68,;19.89,-5.69,;21.23,-6.44,;22.57,-5.68,;21.23,-7.98,;19.9,-8.76,;19.9,-10.3,;21.23,-11.06,;18.57,-11.06,;17.24,-10.29,;15.91,-11.05,;15.91,-12.6,;17.25,-13.37,;18.57,-12.59,;27.89,-1.07,;29.22,-1.85,;27.89,.47,)|
Structure:
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