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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ABL2' and Ligand = 'BDBM481107'   
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
Tyrosine-protein kinase ABL2


(Homo sapiens (Human))
BDBM481107
PNG
(US10906896, Cpd 107)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)C3=NN=C(C3)C(=O)Nc3ccn[nH]3)c2)CC1 |c:39,t:37|
Show InChI InChI=1S/C36H36N12O2/c1-23-3-8-28(40-34(49)25-6-4-24(5-7-25)22-48-15-13-47(2)14-16-48)18-30(23)42-36-38-11-9-29(41-36)26-17-27(21-37-20-26)31-19-32(45-44-31)35(50)43-33-10-12-39-46-33/h3-12,17-18,20-21H,13-16,19,22H2,1-2H3,(H,40,49)(H,38,41,42)(H2,39,43,46,50)
PDB
MMDB

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PC cid
PC sid
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US Patent
n/an/a 67n/an/an/an/an/an/a



Inhibikase Therapeutics, Inc.

US Patent


Assay Description
Kinase base buffer (50 mM HEPES, pH 7.5 0.0015% Brij-35; 10 mM MgCl2 2 mM DTT) and Stop buffer, (100 mM HEPES, pH 7.5 0.015% Brij-35; 0.2% Coating Re...


US Patent US10906896 (2021)


BindingDB Entry DOI: 10.7270/Q2G44TCQ
More data for this
Ligand-Target Pair