Ki Summary

Reaction Details

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Target

Melanocyte-stimulating hormone receptor

Ligand

BDBM50268795

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_523576 (CHEMBL997226)

IC50

2.7±n/a nM

Citation

Qu, H; Cai, M; Mayorov, AV; Grieco, P; Zingsheim, M; Trivedi, D; Hruby, VJ Substitution of arginine with proline and proline derivatives in melanocyte-stimulating hormones leads to selectivity for human melanocortin 4 receptor. J Med Chem52:3627-35 (2009) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Melanocyte-stimulating hormone receptor

Name:

Melanocyte-stimulating hormone receptor

Synonyms:

Type:

Enzyme

Mol. Mass.:

34717.23

Organism:

Homo sapiens (Human)

Description:

Q01726

Residue:

317

Sequence:

MAVQGSQRRLLGSLNSTPTAIPQLGLAANQTGARCLEVSISDGLFLSLGLVSLVENALVV
ATIAKNRNLHSPMYCFICCLALSDLLVSGSNVLETAVILLLEAGALVARAAVLQQLDNVI
DVITCSSMLSSLCFLGAIAVDRYISIFYALRYHSIVTLPRARRAVAAIWVASVVFSTLFI
AYYDHVAVLLCLVVFFLAMLVLMAVLYVHMLARACQHAQGIARLHKRQRPVHQGFGLKGA
VTLTILLGIFFLCWGPFFLHLTLIVLCPEHPTCGCIFKNFNLFLALIICNAIIDPLIYAF
HSQELRRTLKEVLTCSW

BDBM50268795

n/a

Name

BDBM50268795

Synonyms:

Ac-Nle-c[Asp-trans-4-guanidinyl-Pro-DPhe-Arg-Trp-Lys]-NH2 | CHEMBL500743

Type

Small organic molecule

Emp. Form.

C50H72N16O9

Mol. Mass.

1041.2085

SMILES

CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[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]2C[C@H](CN2C1=O)N=C(N)N)C(N)=O |r,wU:4.4,50.52,63.72,12.11,21.76,wD:25.25,39.41,61.68,(21.05,-10.24,;19.69,-9.52,;19.64,-7.97,;18.28,-7.25,;18.23,-5.71,;19.54,-4.89,;19.48,-3.35,;20.79,-2.54,;18.13,-2.63,;16.87,-4.98,;16.82,-3.44,;15.56,-5.8,;14.2,-5.07,;12.89,-5.89,;12.94,-7.43,;14.3,-8.15,;11.63,-8.24,;10.27,-7.52,;8.96,-8.33,;7.6,-7.6,;6.29,-8.41,;4.93,-7.69,;4.88,-6.15,;3.52,-5.42,;2.21,-6.24,;3.47,-3.88,;2.1,-3.15,;.64,-3.65,;-.62,-2.76,;-1.85,-3.68,;-1.35,-5.15,;-2.08,-6.49,;-1.28,-7.8,;.26,-7.76,;.99,-6.41,;.19,-5.12,;4.78,-3.07,;6.1,-3.3,;7.43,-4.09,;4.73,-1.52,;3.37,-.8,;3.32,.74,;1.96,1.47,;1.91,3.01,;.54,3.73,;.5,5.28,;-.76,2.92,;6.03,-.71,;7.4,-1.43,;7.45,-2.98,;8.71,-.62,;8.66,.92,;7.3,1.65,;7.25,3.18,;5.89,3.91,;4.58,3.1,;4.63,1.55,;5.98,.83,;10.06,-1.35,;11.38,-.54,;11.33,1.01,;12.75,-1.27,;13.83,-.17,;15.32,-.56,;15.32,-2.1,;12.78,-2.79,;14.15,-3.53,;15.45,-2.72,;16.54,.37,;16.34,1.9,;14.92,2.5,;17.57,2.84,;3.63,-8.5,;2.26,-7.78,;3.67,-10.04,)|

Structure