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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 9' and Ligand = 'BDBM316200'   
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
Cyclin-dependent kinase 9


(Homo sapiens (Human))
BDBM316200
PNG
(2-methoxy-5-(6-(2-methoxyphenyl)pyrimidin-4-ylamin...)
Show SMILES COc1ccc(Nc2cc(ncn2)-c2ccccc2OC)cc1C(=O)NCc1ccncc1
Show InChI InChI=1S/C25H23N5O3/c1-32-22-6-4-3-5-19(22)21-14-24(29-16-28-21)30-18-7-8-23(33-2)20(13-18)25(31)27-15-17-9-11-26-12-10-17/h3-14,16H,15H2,1-2H3,(H,27,31)(H,28,29,30)
PDB
MMDB

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US Patent
n/an/a<1.00E+3n/an/an/an/an/an/a



VIROSTATICS SRL

US Patent


Assay Description
The activity of the compounds described in the present invention can be determined by measuring the phosphorylation of a fluorescently-labeled peptid...


US Patent US9617225 (2017)


BindingDB Entry DOI: 10.7270/Q29W0HK6
More data for this
Ligand-Target Pair