Reaction Details Report a problem with these data
Target
Melanocortin receptor 4
Ligand
BDBM50184353
Substrate
n/a
Meas. Tech.
ChEMBL_338133 (CHEMBL867660)
IC50
170±n/a nM
Citation
 Mayorov, AV; Cai, M; Chandler, KB; Petrov, RR; Van Scoy, AR; Yu, Z; Tanaka, DK; Trivedi, D; Hruby, VJ Development of cyclic gamma-MSH analogues with selective hMC3R agonist and hMC3R/hMC5R antagonist activities. J Med Chem 49:1946-52 (2006) [PubMed]  Article 
Target
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:
MVNSTHRGMHTSLHLWNRSSYRLHSNASESLGKGYSDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVKRVGIIISCIWAACTVSGILFIIYSDSSAVIICLITMFFTMLALMASLYVHMFLMARLHIKRIAVLPGTGAIRQGANMKGAITLTILIGVFVVCWAPFFLHLIFYISCPQNPYCVCFMSHFNLYLILIMCNSIIDPLIYALRSQELRKTFKEIICCYPLGGLCDLSSRY
  
Inhibitor
Name:
BDBM50184353
Synonyms:
CHEMBL446185 | c[Nle-His-D-Phe-Arg-Trp-Glu]-NH2
Type:
Small organic molecule
Emp. Form.:
C43H57N13O7
Mol. Mass.:
867.9956
SMILES:
CCCC[C@@H]1NC(=O)CC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(N)=O |wU:39.41,10.64,wD:14.14,50.53,28.30,4.3,(-.32,4.4,;-.32,2.86,;.76,2.14,;.76,.63,;1.98,-.07,;3.68,.55,;3.68,2.09,;2.35,2.85,;4.9,2.86,;5.42,4.15,;6.93,4.36,;7.7,3.02,;8.46,1.7,;9.95,2.11,;8.86,.21,;10.39,.21,;11.17,-1.13,;11.16,-2.67,;12.63,-3.15,;13.52,-1.91,;15.06,-1.76,;15.7,-.36,;14.79,.9,;13.27,.74,;12.64,-.65,;7.92,-1,;8.51,-2.43,;10.04,-2.42,;8.1,-3.91,;9.2,-5,;10.69,-4.6,;11.77,-5.68,;13.25,-5.29,;14.34,-6.38,;15.83,-5.98,;13.95,-7.86,;6.76,-4.68,;5.44,-3.89,;5.45,-2.36,;4.11,-4.66,;4.1,-6.2,;5.43,-6.97,;5.42,-8.51,;6.75,-9.28,;8.09,-8.51,;8.08,-6.96,;6.75,-6.2,;2.77,-3.89,;1.43,-4.65,;1.41,-6.19,;.09,-3.87,;-1.23,-4.64,;-2.57,-3.87,;-2.73,-2.33,;-4.24,-2.01,;-5.02,-3.35,;-3.98,-4.5,;.09,-2.33,;1.64,-1.59,;2.86,-2.34,;7.71,5.69,;6.94,7.03,;9.25,5.69,)|
Structure:
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