BDBM11460 2,6,9-trisubstituted adenine derivative::2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9H-purine-2,6-diamine::2-[TRANS-(4-AMINOCYCLOHEXYL)AMINO]-6-(BENZYL-AMINO)-9-CYCLOPENTYLPURINE::H717

SMILES N[C@H]1CC[C@@H](CC1)Nc1nc(NCc2ccccc2)c2ncn(C3CCCC3)c2n1

InChI Key InChIKey=JTVILUUAQWQWBK-UHFFFAOYSA-N

Data  7 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 11460   

TargetCyclin-dependent kinase 1(Human)
Palack£

Curated by ChEMBL
LigandPNGBDBM11460(2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9...)
Affinity DataIC50: 52nMAssay Description:Inhibition of human recombinant CDK1More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCyclin-dependent kinase 2/G1/S-specific cyclin-E1(Human)
Lawrence Berkeley National Laboratory

LigandPNGBDBM11460(2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9...)
Affinity DataIC50: 48nMpH: 7.5 T: 2°CAssay 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...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/10/2006
Entry Details Article
PubMed
TargetCyclin-dependent kinase 4/G1/S-specific cyclin-D1(Human)
Lawrence Berkeley National Laboratory

LigandPNGBDBM11460(2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9...)
Affinity DataIC50: 3.60E+3nMpH: 7.5 T: 2°CAssay 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...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/10/2006
Entry Details Article
PubMed
TargetCyclin-dependent kinase/G2/mitotic-specific cyclin- 1(Human)
Lawrence Berkeley National Laboratory

LigandPNGBDBM11460(2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9...)
Affinity DataIC50: 52nMpH: 8.0 T: 2°CAssay Description:The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 0.5 uM ATP/ [gamma-33P] ATP. Af...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/10/2006
Entry Details Article
PubMed
TargetReceptor-type tyrosine-protein kinase FLT3(Human)
Palack£

Curated by ChEMBL
LigandPNGBDBM11460(2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9...)
Affinity DataIC50: 2.51E+3nMAssay Description:Inhibition of FLT3 ITD mutant (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details
PubMed
LigandPNGBDBM11460(2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9...)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of PDGFRalpha (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details
PubMed
TargetCyclin-dependent kinase 2(Human)
Palack£

Curated by ChEMBL
LigandPNGBDBM11460(2-N-(4-aminocyclohexyl)-6-N-benzyl-9-cyclopentyl-9...)
Affinity DataIC50: 7nMAssay Description:Inhibition of CDK2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details
PubMed