Reaction Details Report a problem with these data
Target
Melanocortin receptor 4
Ligand
BDBM50165931
Substrate
n/a
Meas. Tech.
ChEMBL_302520 (CHEMBL827373)
Ki
0.090000±n/a nM
Citation
Mayer, JP; Hsiung, HM; Flora, DB; Edwards, P; Smith, DP; Zhang, XY; Gadski, RA; Heiman, ML; Hertel, JL; Emmerson, PJ; Husain, S; O'brien, TP; Kahl, SD; Smiley, DL; Zhang, L; Dimarchi, RD; Yan, LZ Discovery of a beta-MSH-derived MC-4R selective agonist. J Med Chem 48:3095-8 (2005) [PubMed] Article
More Info.:
Target
Name:
Melanocortin receptor 4
Synonyms:
MC4-R | MC4R_RAT | Mc4r
Type:
PROTEIN
Mol. Mass.:
36892.87
Organism:
Rattus norvegicus
Description:
ChEMBL_11005
Residue:
332
Sequence:
MNSTHHHGMYTSLHLWNRSSHGLHGNASESLGKGHSDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVRRVGIIISCIWAACTVSGVLFIIYSDSSAVIICLITMFFTMLVLMASLYVHMFLMARLHIKRIAVLPGTGTIRQGANMKGAITLTILIGVFVVCWAPFFLHLLFYISCPQNPYCVCFMSHFNLYLILIMCNAVIDPLIYALRSQELRKTFKEIICFYPLGGICELPGRY
Inhibitor
Name:
BDBM50165931
Synonyms:
CHEMBL415165 | NDP-SYSMEHFRWGKPVG
Type:
Small organic molecule
Emp. Form.:
C90H127N25O26S
Mol. Mass.:
2007.188
SMILES:
CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCC(O)=O