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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50215650   
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
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50215650
PNG
(1-((3R,6S)-6-(3-cyanophenyl)bicyclo[4.1.0]heptan-3...)
Show SMILES CC(C)N(CCN([C@@H]1CC[C@@]2(CC2C1)c1cccc(c1)C#N)C(=O)Nc1cc(F)cc(F)c1)C(C)C |w:12.13|
Show InChI InChI=1S/C29H36F2N4O/c1-19(2)34(20(3)4)10-11-35(28(36)33-26-15-24(30)14-25(31)16-26)27-8-9-29(17-23(29)13-27)22-7-5-6-21(12-22)18-32/h5-7,12,14-16,19-20,23,27H,8-11,13,17H2,1-4H3,(H,33,36)/t23?,27-,29-/m1/s1
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Article
PubMed
4.5n/an/an/an/an/an/an/an/a



Universidad de Cartagena

Curated by ChEMBL


Assay Description
Antagonist activity at MCH1 receptor


Eur J Med Chem 45: 4509-22 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.011
BindingDB Entry DOI: 10.7270/Q2FT8N9V
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50215650
PNG
(1-((3R,6S)-6-(3-cyanophenyl)bicyclo[4.1.0]heptan-3...)
Show SMILES CC(C)N(CCN([C@@H]1CC[C@@]2(CC2C1)c1cccc(c1)C#N)C(=O)Nc1cc(F)cc(F)c1)C(C)C |w:12.13|
Show InChI InChI=1S/C29H36F2N4O/c1-19(2)34(20(3)4)10-11-35(28(36)33-26-15-24(30)14-25(31)16-26)27-8-9-29(17-23(29)13-27)22-7-5-6-21(12-22)18-32/h5-7,12,14-16,19-20,23,27H,8-11,13,17H2,1-4H3,(H,33,36)/t23?,27-,29-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
4.5n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute K15 2545

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from MCHR1 expressed in CHO cells


Bioorg Med Chem 15: 5369-85 (2007)


Article DOI: 10.1016/j.bmc.2007.05.068
BindingDB Entry DOI: 10.7270/Q25T3K5V
More data for this
Ligand-Target Pair