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BDBM50235754 (2S,3S)-methyl 2-(1-(2-((S)-1-amino-2-methylpropyl)-4-methylphenyl)piperazine-4-carbonyl)-3-(4-chlorophenyl)pyrrolidine-1-carboxylate::CHEMBL402822

SMILES: COC(=O)N1CC[C@H]([C@H]1C(=O)N1CCN(CC1)c1ccc(C)cc1[C@@H](N)C(C)C)c1ccc(Cl)cc1

InChI Key: InChIKey=QFNYNYUWRSANTP-HRNNMHKYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50235754   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50235754
PNG
((2S,3S)-methyl 2-(1-(2-((S)-1-amino-2-methylpropyl...)
Show SMILES COC(=O)N1CC[C@H]([C@H]1C(=O)N1CCN(CC1)c1ccc(C)cc1[C@@H](N)C(C)C)c1ccc(Cl)cc1
Show InChI InChI=1S/C28H37ClN4O3/c1-18(2)25(30)23-17-19(3)5-10-24(23)31-13-15-32(16-14-31)27(34)26-22(11-12-33(26)28(35)36-4)20-6-8-21(29)9-7-20/h5-10,17-18,22,25-26H,11-16,30H2,1-4H3/t22-,25-,26-/m0/s1
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PC sid
UniChem

Similars
Article
PubMed
 53n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125]NDPMSH from human MC4 receptor expressed in HEK293 cells

Bioorg Med Chem Lett 18: 1931-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.125
BindingDB Entry DOI: 10.7270/Q2WD409C
More data for this
Ligand-Target Pair