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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(3) dopamine receptor' and Ligand = 'BDBM129720'   
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
D(3) dopamine receptor


(Rattus norvegicus (Rat))
BDBM129720
PNG
(US8802672, 10)
Show SMILES CCNC(=O)NC1CCC(CCN2CCN(CC2)c2nc(NC)nc(Cl)c2Cl)CC1 |(-6.67,-10.01,;-8,-9.24,;-9.34,-10.01,;-10.67,-9.24,;-10.67,-7.7,;-12,-10.01,;-13.34,-9.24,;-14.67,-10.01,;-16,-9.24,;-16,-7.7,;-17.34,-6.93,;-18.67,-7.7,;-20.01,-6.93,;-21.34,-7.7,;-22.67,-6.93,;-22.67,-5.39,;-21.34,-4.62,;-20.01,-5.39,;-24.01,-4.62,;-25.34,-5.39,;-26.67,-4.62,;-28.01,-5.39,;-28.01,-6.93,;-26.67,-3.08,;-25.34,-2.31,;-25.34,-.77,;-24.01,-3.08,;-22.67,-2.31,;-14.67,-6.93,;-13.34,-7.7,)|
Show InChI InChI=1S/C20H33Cl2N7O/c1-3-24-20(30)25-15-6-4-14(5-7-15)8-9-28-10-12-29(13-11-28)18-16(21)17(22)26-19(23-2)27-18/h14-15H,3-13H2,1-2H3,(H,23,26,27)(H2,24,25,30)
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
<1n/an/an/an/an/an/an/an/a



Richter Gedeon Nyrt.

US Patent


Assay Description
Binding assays were carried out on rat recombinant D3 receptors (Perkin-Elmer, Cat. No. 6110139) expressed in Sf9 cells using [3H]spiperone (0.44-1.4...


US Patent US8802672 (2014)


BindingDB Entry DOI: 10.7270/Q2FF3R1T
More data for this
Ligand-Target Pair