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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 = 'BDBM50225588'   
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))		BDBM50225588
PNG
((4-(1-((4-isopropoxybenzylamino)methyl)cyclohexyl)...)
Show SMILES CC(C)Oc1ccc(CNCC2(CCCCC2)N2CCN(CC2)C(=O)[C@H]2CN(C[C@@H]2c2ccc(Cl)cc2)C(C)C)cc1
Show InChI InChI=1S/C35H51ClN4O2/c1-26(2)39-23-32(29-10-12-30(36)13-11-29)33(24-39)34(41)38-18-20-40(21-19-38)35(16-6-5-7-17-35)25-37-22-28-8-14-31(15-9-28)42-27(3)4/h8-15,26-27,32-33,37H,5-7,16-25H2,1-4H3/t32-,33+/m1/s1
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PC cid
PC sid
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Similars
Article
PubMed
 2.10n/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