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PDB code 1G5S

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
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
CDK2/CycE

  (298/298 = 100%)
(Homo sapiens (Human))
BDBM11460
PNG
(2,6,9-trisubstituted adenine derivative | 2-N-(4-a...)
Show SMILES N[C@H]1CC[C@@H](CC1)Nc1nc(NCc2ccccc2)c2ncn(C3CCCC3)c2n1
Show InChI InChI=1S/C23H31N7/c24-17-10-12-18(13-11-17)27-23-28-21(25-14-16-6-2-1-3-7-16)20-22(29-23)30(15-26-20)19-8-4-5-9-19/h1-3,6-7,15,17-19H,4-5,8-14,24H2,(H2,25,27,28,29)/t17-,18-
PDB

UniProtKB/SwissProt

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PC cid
PC sid
PDB
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Similars

PDB
Article
PubMed
n/an/a 48n/an/an/an/a7.530



Lawrence Berkeley National Laboratory



Assay Description
The enzyme was assayed with substrate GST-Rb in the presence of 10 uM ATP/[gamma-33P] ATP, and capturing the 33-P labeled reaction products on GSH-Se...


J Med Chem 44: 524-30 (2001)


Article DOI: 10.1021/jm001043t
BindingDB Entry DOI: 10.7270/Q2Q23XGD
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output