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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 = 'BDBM457878'   
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))
BDBM457878
PNG
(US10752588, Compound 35b)
Show SMILES COc1cccc(c1)[C@@H](NC(=O)C1CCN(CCOc2ccccc2)CC1)c1ccccn1 |r|
Show InChI InChI=1S/C27H31N3O3/c1-32-24-11-7-8-22(20-24)26(25-12-5-6-15-28-25)29-27(31)21-13-16-30(17-14-21)18-19-33-23-9-3-2-4-10-23/h2-12,15,20-21,26H,13-14,16-19H2,1H3,(H,29,31)/t26-/m1/s1
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US Patent
550n/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