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BDBM50326864 CHEMBL1254883::N-((3R,4R,5S,6R)-4-(4-chlorobenzyloxy)-5-hydroxy-6-(methoxymethyl)-2-(naphthalen-2-ylmethoxy)tetrahydro-2H-pyran-3-yl)-2-(diaminomethyleneamino)acetamide

SMILES: [#6]-[#8]-[#6]-[#6@H]-1-[#8]-[#6](-[#8]-[#6]-c2ccc3ccccc3c2)-[#6@H](-[#7]-[#6](=O)-[#6]\[#7]=[#6](\[#7])-[#7])-[#6@@H](-[#8]-[#6]-c2ccc(Cl)cc2)-[#6@@H]-1-[#8]

InChI Key: InChIKey=TVYZVZKXWZCIIM-XJNFUARPSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50326864   
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


(Homo sapiens (Human))
BDBM50326864
PNG
(CHEMBL1254883 | N-((3R,4R,5S,6R)-4-(4-chlorobenzyl...)
Show SMILES [#6]-[#8]-[#6]-[#6@H]-1-[#8]-[#6](-[#8]-[#6]-c2ccc3ccccc3c2)-[#6@H](-[#7]-[#6](=O)-[#6]\[#7]=[#6](\[#7])-[#7])-[#6@@H](-[#8]-[#6]-c2ccc(Cl)cc2)-[#6@@H]-1-[#8] |r|
Show InChI InChI=1S/C28H33ClN4O6/c1-36-16-22-25(35)26(37-14-17-7-10-21(29)11-8-17)24(33-23(34)13-32-28(30)31)27(39-22)38-15-18-6-9-19-4-2-3-5-20(19)12-18/h2-12,22,24-27,35H,13-16H2,1H3,(H,33,34)(H4,30,31,32)/t22-,24-,25-,26-,27?/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
6.60E+3n/an/an/an/an/an/an/an/a



Alchemia Ltd

Curated by ChEMBL


Assay Description
Displacement of [I125I]MCH from human MCH1 receptor expressed in CHO cells by scintillation counting


J Med Chem 53: 5576-86 (2010)


Article DOI: 10.1021/jm1002777
BindingDB Entry DOI: 10.7270/Q2QC03QK
More data for this
Ligand-Target Pair