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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 = 'BDBM50134509'   
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))		BDBM50134509
PNG
((R)-1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic a...)
Show SMILES CC(C)CN(Cc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1)S(C)(=O)=O
Show InChI InChI=1S/C35H44ClN5O4S/c1-25(2)23-41(46(3,44)45)24-29-10-6-7-11-33(29)39-16-18-40(19-17-39)35(43)32(20-26-12-14-30(36)15-13-26)38-34(42)31-21-27-8-4-5-9-28(27)22-37-31/h4-15,25,31-32,37H,16-24H2,1-3H3,(H,38,42)/t31-,32-/m1/s1
PDB

KEGG

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PC cid
PC sid
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Similars
PubMed
n/an/an/an/a 380n/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Agonistic activity measured as inhibition of cAMP accumulation in HEK cells expressing human Melanocortin 4 receptor (hMC4R)

Bioorg Med Chem Lett 13: 3793-6 (2003)


BindingDB Entry DOI: 10.7270/Q2P26ZNW
More data for this
Ligand-Target Pair