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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 323355   
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
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM323355
PNG
(US9630956, Compound I-92)
Show SMILES Nc1ncc(nc1-c1cc(no1)-c1ccc(CNC2CC2)cc1)-c1ccc(=O)n(c1)C1CCCC1
Show InChI InChI=1S/C27H28N6O2/c28-27-26(24-13-22(32-35-24)18-7-5-17(6-8-18)14-29-20-10-11-20)31-23(15-30-27)19-9-12-25(34)33(16-19)21-3-1-2-4-21/h5-9,12-13,15-16,20-21,29H,1-4,10-11,14H2,(H2,28,30)
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US Patent
<5n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals Incorporated

US Patent


Assay Description
Compounds were screened for their ability to inhibit ATR kinase using a radioactive-phosphate incorporation assay. Assays were carried out in a mixtu...


US Patent US9630956 (2017)


BindingDB Entry DOI: 10.7270/Q2X63Q2S
More data for this
Ligand-Target Pair