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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 = 'BDBM50221116'   
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))		BDBM50221116
PNG
(1-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-((S)-1-(2-hy...)
Show SMILES CC(C)C[C@H](NCCO)c1cc(ccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)N1CCCC1=O)C(F)(F)F
Show InChI InChI=1S/C31H39Cl2F3N4O3/c1-20(2)16-26(37-9-15-41)24-18-22(31(34,35)36)6-8-27(24)38-11-13-39(14-12-38)30(43)28(40-10-3-4-29(40)42)17-21-5-7-23(32)19-25(21)33/h5-8,18-20,26,28,37,41H,3-4,9-17H2,1-2H3/t26-,28+/m0/s1
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Similars
Article
PubMed
 8.70n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Binding affinity at human MC4R

Bioorg Med Chem Lett 17: 5610-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.097
BindingDB Entry DOI: 10.7270/Q2XK8F8V
More data for this
Ligand-Target Pair