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BDBM50069862 (2-Difluoromethoxy-benzyl)-((2S,3S)-2-phenyl-piperidin-3-yl)-amine::CHEMBL95852

SMILES: FC(F)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1

InChI Key: InChIKey=KOHCJNXQELPZKP-WMZOPIPTSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50069862   
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
Neurokinin 1 receptor


(Homo sapiens (Human))
BDBM50069862
PNG
((2-Difluoromethoxy-benzyl)-((2S,3S)-2-phenyl-piper...)
Show SMILES FC(F)Oc1ccccc1CN[C@H]1CCCN[C@H]1c1ccccc1
Show InChI InChI=1S/C19H22F2N2O/c20-19(21)24-17-11-5-4-9-15(17)13-23-16-10-6-12-22-18(16)14-7-2-1-3-8-14/h1-5,7-9,11,16,18-19,22-23H,6,10,12-13H2/t16-,18-/m0/s1
PDB
MMDB

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PubMed
n/an/a 0.410n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity for Tachykinin receptor 1 as displacement of [3H]-Substance P in human IM-9 cells


Bioorg Med Chem Lett 8: 281-4 (1999)


BindingDB Entry DOI: 10.7270/Q2Z60PK8
More data for this
Ligand-Target Pair