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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent dopamine transporter' and Ligand = 'BDBM50175150'   
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 dopamine transporter


(Rattus norvegicus (rat))
BDBM50175150
PNG
(CHEMBL197707 | N-(bis(4-fluorophenyl)methyl)-8-(4-...)
Show SMILES Fc1ccc(cc1)C(NC1CC2CCC(C1)N2CCCCc1ccccc1)c1ccc(F)cc1 |TLB:8:9:12.13:16,17:16:12.13:15.10.9|
Show InChI InChI=1S/C30H34F2N2/c31-25-13-9-23(10-14-25)30(24-11-15-26(32)16-12-24)33-27-20-28-17-18-29(21-27)34(28)19-5-4-8-22-6-2-1-3-7-22/h1-3,6-7,9-16,27-30,33H,4-5,8,17-21H2
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PC cid
PC sid
UniChem

Similars

Article
PubMed
11.7n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse--Intramural Research Program

Curated by ChEMBL


Assay Description
Displacement of [3H]WIN-from DAT in rat brain membrane


Bioorg Med Chem Lett 15: 5419-23 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.111
BindingDB Entry DOI: 10.7270/Q2KP82XR
More data for this
Ligand-Target Pair