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BDBM50337394 (1S,2R)-2-((4-acetamido-4-phenylpiperidin-1-yl)methyl)-1-(3-cyanophenyl)-N-(4-fluorobenzyl)-N-methylcyclopropanecarboxamide::CHEMBL1682659

SMILES: CN(Cc1ccc(F)cc1)C(=O)[C@]1(C[C@H]1CN1CCC(CC1)(NC(C)=O)c1ccccc1)c1cccc(c1)C#N

InChI Key: InChIKey=UFWKEBZNAVQKSE-RYCFQHDISA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50337394   
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
Neuromedin-K receptor


(Homo sapiens (Human))
BDBM50337394
PNG
((1S,2R)-2-((4-acetamido-4-phenylpiperidin-1-yl)met...)
Show SMILES CN(Cc1ccc(F)cc1)C(=O)[C@]1(C[C@H]1CN1CCC(CC1)(NC(C)=O)c1ccccc1)c1cccc(c1)C#N |r|
Show InChI InChI=1S/C33H35FN4O2/c1-24(39)36-32(27-8-4-3-5-9-27)15-17-38(18-16-32)23-29-20-33(29,28-10-6-7-26(19-28)21-35)31(40)37(2)22-25-11-13-30(34)14-12-25/h3-14,19,29H,15-18,20,22-23H2,1-2H3,(H,36,39)/t29-,33+/m0/s1
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Similars

Article
PubMed
1.90E+3n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]Lu AE93103 from human NK3 receptor expressed in BHK cells


Bioorg Med Chem Lett 21: 1498-501 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.135
BindingDB Entry DOI: 10.7270/Q23J3D8R
More data for this
Ligand-Target Pair