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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM50155378'   
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))
BDBM50155378
PNG
((+/-)-1-(1-(4-fluorophenyl)-2-{4-[4-(2-methoxy-1-n...)
Show SMILES COc1ccc2ccccc2c1CCCCN1CCN(CC(N2CCN(C)CC2)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C32H43FN4O/c1-34-17-23-37(24-18-34)31(27-10-13-28(33)14-11-27)25-36-21-19-35(20-22-36)16-6-5-9-30-29-8-4-3-7-26(29)12-15-32(30)38-2/h3-4,7-8,10-15,31H,5-6,9,16-25H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.90n/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Tested for inhibition of binding to MC4 receptor


Bioorg Med Chem Lett 14: 5605-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.055
BindingDB Entry DOI: 10.7270/Q2DB82K8
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50155378
PNG
((+/-)-1-(1-(4-fluorophenyl)-2-{4-[4-(2-methoxy-1-n...)
Show SMILES COc1ccc2ccccc2c1CCCCN1CCN(CC(N2CCN(C)CC2)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C32H43FN4O/c1-34-17-23-37(24-18-34)31(27-10-13-28(33)14-11-27)25-36-21-19-35(20-22-36)16-6-5-9-30-29-8-4-3-7-26(29)12-15-32(30)38-2/h3-4,7-8,10-15,31H,5-6,9,16-25H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 57.3n/an/an/an/an/an/a



Taisho Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]Nle4-D-Phe7-alpha-MSH from human MC4 receptor expressed in COS1 cells


Bioorg Med Chem 15: 1989-2005 (2007)


Article DOI: 10.1016/j.bmc.2006.12.039
BindingDB Entry DOI: 10.7270/Q2C53KHN
More data for this
Ligand-Target Pair