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SMILES: CC(C)N(CCN([C@@H]1CC[C@@]2(CC2C1)c1cccc(Br)c1)C(=O)Nc1ccc(F)c(F)c1)C(C)C

InChI Key: InChIKey=AVQPXABTEFSDRR-UOOTYMSZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50215651   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50215651
PNG
(1-((3R,6S)-6-(3-bromophenyl)bicyclo[4.1.0]heptan-3...)
Show SMILES CC(C)N(CCN([C@@H]1CC[C@@]2(CC2C1)c1cccc(Br)c1)C(=O)Nc1ccc(F)c(F)c1)C(C)C |w:12.13|
Show InChI InChI=1S/C28H36BrF2N3O/c1-18(2)33(19(3)4)12-13-34(27(35)32-23-8-9-25(30)26(31)16-23)24-10-11-28(17-21(28)15-24)20-6-5-7-22(29)14-20/h5-9,14,16,18-19,21,24H,10-13,15,17H2,1-4H3,(H,32,35)/t21?,24-,28-/m1/s1
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PC sid
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Similars

Article
PubMed
7.76n/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))
BDBM50215651
PNG
(1-((3R,6S)-6-(3-bromophenyl)bicyclo[4.1.0]heptan-3...)
Show SMILES CC(C)N(CCN([C@@H]1CC[C@@]2(CC2C1)c1cccc(Br)c1)C(=O)Nc1ccc(F)c(F)c1)C(C)C |w:12.13|
Show InChI InChI=1S/C28H36BrF2N3O/c1-18(2)33(19(3)4)12-13-34(27(35)32-23-8-9-25(30)26(31)16-23)24-10-11-28(17-21(28)15-24)20-6-5-7-22(29)14-20/h5-9,14,16,18-19,21,24H,10-13,15,17H2,1-4H3,(H,32,35)/t21?,24-,28-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
7.80n/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