BDBM7557 1-[6-(benzylamino)-9-(propan-2-yl)-9H-purin-2-yl]pent-1-yn-3-ol::C-2 alkynylated purine deriv. 2e::CHEMBL445125

SMILES CCC(O)C#Cc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1

InChI Key InChIKey=DKJBMDONLLGPRA-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 7557   

TargetCyclin-dependent kinase 1/G2/mitotic-specific cyclin-B(Spiny starfish)
Institut Curie

LigandPNGBDBM7557(CHEMBL445125 | 1-[6-(benzylamino)-9-(propan-2-yl)-...)
Affinity DataIC50: 500nMpH: 7.2 T: 2°CAssay Description:Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/ [gamma-32P] ATP. 32...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2006
Entry Details Article
PubMed
TargetCyclin-dependent kinase 1(Human)
Institut Curie

Curated by ChEMBL
LigandPNGBDBM7557(CHEMBL445125 | 1-[6-(benzylamino)-9-(propan-2-yl)-...)
Affinity DataIC50: 500nMAssay Description:Inhibition of cyclin-dependent kinase 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/25/2012
Entry Details Article
PubMed