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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 = 'BDBM50266701'   
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


(Mus musculus)		BDBM50266701
PNG
(CHEMBL4064728)
Show SMILES CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1csc2ccccc12)C(N)=O |r|
Show InChI InChI=1S/C38H43IN8O5S/c1-22(48)47-20-25-8-3-2-7-24(25)19-32(47)37(52)44-29(10-6-16-43-38(41)42)35(50)46-31(17-23-12-14-27(39)15-13-23)36(51)45-30(34(40)49)18-26-21-53-33-11-5-4-9-28(26)33/h2-5,7-9,11-15,21,29-32H,6,10,16-20H2,1H3,(H2,40,49)(H,44,52)(H,45,51)(H,46,50)(H4,41,42,43)/t29-,30-,31+,32-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Agonist activity at mouse MC4R expressed in HEK293 cells assessed as induction of cAMP accumulation after 2 hrs by alpha screen assay

J Med Chem 60: 4342-4357 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00301
BindingDB Entry DOI: 10.7270/Q24170J1
More data for this
Ligand-Target Pair