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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 2' and Ligand = 'BDBM105244'   
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 2


(Homo sapiens (Human))
BDBM105244
PNG
(US8580782, 18)
Show SMILES CN1CCN(CC1)c1cc(NCc2cccnc2)n2ncc(Br)c2n1
Show InChI InChI=1S/C17H20BrN7/c1-23-5-7-24(8-6-23)16-9-15(20-11-13-3-2-4-19-10-13)25-17(22-16)14(18)12-21-25/h2-4,9-10,12,20H,5-8,11H2,1H3
PDB
MMDB

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Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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Similars

US Patent
n/an/a 140n/an/an/an/a8.0n/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
CDK2 kinase assays (either cyclin A or cyclin E-dependent) were performed in low protein binding 96-well plates (Corning Inc., Corning, N.Y.).


US Patent US8580782 (2013)


BindingDB Entry DOI: 10.7270/Q2VM49WG
More data for this
Ligand-Target Pair