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BDBM50189225 (S)-1-(4-(2-(1-amino-3-methylbutyl)-4-(trifluoromethyl)phenyl)piperazin-1-yl)-3-(2,4,5-trimethoxyphenyl)propan-1-one::CHEMBL216009

SMILES: COc1cc(OC)c(OC)cc1CCC(=O)N1CCN(CC1)c1ccc(cc1[C@@H](N)CC(C)C)C(F)(F)F

InChI Key: InChIKey=LXNDVQBLBLFJSL-QFIPXVFZSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50189225   
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
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50189225
PNG
((S)-1-(4-(2-(1-amino-3-methylbutyl)-4-(trifluorome...)
Show SMILES COc1cc(OC)c(OC)cc1CCC(=O)N1CCN(CC1)c1ccc(cc1[C@@H](N)CC(C)C)C(F)(F)F
Show InChI InChI=1S/C28H38F3N3O4/c1-18(2)14-22(32)21-16-20(28(29,30)31)7-8-23(21)33-10-12-34(13-11-33)27(35)9-6-19-15-25(37-4)26(38-5)17-24(19)36-3/h7-8,15-18,22H,6,9-14,32H2,1-5H3/t22-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.10E+3n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Activity at MC4R assessed as inhibition of alpha-MSH-stimulated cAMP production


Bioorg Med Chem Lett 16: 4674-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.088
BindingDB Entry DOI: 10.7270/Q2C53KFR
More data for this
Ligand-Target Pair