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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent noradrenaline transporter' and Ligand = 'BDBM436509'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM436509
PNG
(6-(3-(4- (((cyclopropylmethyl) amino)methyl)-1H- 1...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-n1cc(CNCC3CC3)nn1)C2=O
Show InChI InChI=1S/C23H29N9O/c1-3-25-23-26-14-20-21(27-23)30(2)9-10-31(22(20)33)18-5-4-6-19(11-18)32-15-17(28-29-32)13-24-12-16-7-8-16/h4-6,11,14-16,24H,3,7-10,12-13H2,1-2H3,(H,25,26,27)
PDB

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US Patent
300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


BindingDB Entry DOI: 10.7270/Q2WM1HGR
More data for this
Ligand-Target Pair