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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM50225647'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50225647
PNG
(1-((3R,4S)-3-(1-(1-((benzylamino)methyl)cyclohexyl...)
Show SMILES CCC(=O)N1C[C@@H]([C@H](C1)c1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1(CNCc2ccccc2)CCCCC1
Show InChI InChI=1S/C32H43ClN4O2/c1-2-30(38)36-22-28(26-11-13-27(33)14-12-26)29(23-36)31(39)35-17-19-37(20-18-35)32(15-7-4-8-16-32)24-34-21-25-9-5-3-6-10-25/h3,5-6,9-14,28-29,34H,2,4,7-8,15-24H2,1H3/t28-,29+/m1/s1
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PC cid
PC sid
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Similars
Article
PubMed
 210n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Displacement of [12]NDPMSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 17: 6825-31 (2007)


Article DOI: 10.1016/j.bmcl.2007.10.032
BindingDB Entry DOI: 10.7270/Q2862G5Z
More data for this
Ligand-Target Pair