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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 3' and Ligand = 'BDBM50167677'   
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 3


(Homo sapiens (Human))		BDBM50167677
PNG
((2S,4R)-4-Benzyl-1-{(S)-2-[2-(3,4-dichloro-phenyl)...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)Cc1ccc(Cl)c(Cl)c1)C(=O)N1C[C@H](Cc2ccccc2)C[C@H]1C(=O)NCc1ccccc1
Show InChI InChI=1S/C33H38Cl2N6O3/c34-26-14-13-24(17-27(26)35)19-30(42)40-28(12-7-15-38-33(36)37)32(44)41-21-25(16-22-8-3-1-4-9-22)18-29(41)31(43)39-20-23-10-5-2-6-11-23/h1-6,8-11,13-14,17,25,28-29H,7,12,15-16,18-21H2,(H,39,43)(H,40,42)(H4,36,37,38)/t25-,28+,29+/m1/s1
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Article
PubMed
 900n/an/an/an/an/an/an/an/a



Procter& Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity towards human Melanocortin 3 Receptor

Bioorg Med Chem Lett 15: 2819-23 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.120
BindingDB Entry DOI: 10.7270/Q2F76DBS
More data for this
Ligand-Target Pair