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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM457898'   
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(2) dopamine receptor


(Homo sapiens (Human))
BDBM457898
PNG
(US10752588, Compound 69b)
Show SMILES CC1(CCN(CCOc2ccccc2)CC1)C(=O)NC(c1ccc(F)cc1)c1ccccn1
Show InChI InChI=1S/C27H30FN3O2/c1-27(14-17-31(18-15-27)19-20-33-23-7-3-2-4-8-23)26(32)30-25(24-9-5-6-16-29-24)21-10-12-22(28)13-11-21/h2-13,16,25H,14-15,17-20H2,1H3,(H,30,32)
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US Patent
55n/an/an/an/an/an/an/an/a



The Broad Institute, Inc.; Massachusetts Institute of Technology

US Patent


Assay Description
radioligand binding assay.


US Patent US10752588 (2020)


BindingDB Entry DOI: 10.7270/Q27H1NNQ
More data for this
Ligand-Target Pair