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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Breakpoint cluster region protein [1-693]' and Ligand = 'BDBM111461'   
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
Breakpoint cluster region protein [1-693]


(Homo sapiens (Human))
BDBM111461
PNG
(N-(3-methoxyphenyl)-4-methyl-3-(4-(pyridin-3-yl) p...)
Show SMILES COc1cccc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)c1
Show InChI InChI=1S/C24H21N5O2/c1-16-8-9-17(23(30)27-19-6-3-7-20(14-19)31-2)13-22(16)29-24-26-12-10-21(28-24)18-5-4-11-25-15-18/h3-15H,1-2H3,(H,27,30)(H,26,28,29)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 5.24E+3n/an/an/an/an/an/a



Xi'an Jiaotong University, No. 76, Yanta West Road, Xi'an, 710061, China



Assay Description
ATP (6.021 μM) and substrate (457.7 nM) were used. Kinase, substrate peptide, and inhibitor were added in a 384-well plate. The reaction was s...


Chem Biol Drug Des 83: 592-9 (2014)


Article DOI: 10.1111/cbdd.12272
BindingDB Entry DOI: 10.7270/Q2GX497N
More data for this
Ligand-Target Pair