BDBM50121656 CHEMBL3616869

SMILES CSc1ccc(\C=N\c2cc(ccc2O)[N+]([O-])=O)cc1

InChI Key InChIKey=QMRCPJWGPKSHGQ-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 = 50121656   

TargetCyclin-dependent kinase 2(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50121656(CHEMBL3616869)
Affinity DataIC50: 1.51E+5nMAssay Description:Binding affinity to human CDK2 Y180A mutant expressed in Escherichia coli BL21 assessed as inhibition of interaction with cyclin A3 by measuring HHAS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2016
Entry Details Article
PubMed
TargetCyclin-dependent kinase 2(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50121656(CHEMBL3616869)
Affinity DataIC50: 8.85E+5nMAssay Description:Binding affinity to human CDK2 R150A mutant expressed in Escherichia coli BL21 assessed as inhibition of interaction with cyclin A3 by measuring HHAS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2016
Entry Details Article
PubMed
TargetCyclin-dependent kinase 2(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50121656(CHEMBL3616869)
Affinity DataIC50: 6.98E+4nMAssay Description:Binding affinity to N-terminal His-tagged recombinant human CDK2 (1 to 298 amino acid residues) expressed in Escherichia coli BL21 assessed as inhibi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2016
Entry Details Article
PubMed
TargetCyclin-dependent kinase 2(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50121656(CHEMBL3616869)
Affinity DataIC50: 5.82E+4nMAssay Description:Binding affinity to N-terminal His-tagged recombinant human CDK2 (1 to 298 amino acid residues) expressed in Escherichia coli BL21 assessed as inhibi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2016
Entry Details Article
PubMed
TargetCyclin-dependent kinase 2(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50121656(CHEMBL3616869)
Affinity DataIC50: 5.51E+4nMAssay Description:Binding affinity to N-terminal His-tagged recombinant human CDK2 (1 to 298 amino acid residues) expressed in Escherichia coli BL21 assessed as inhibi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2016
Entry Details Article
PubMed
TargetCyclin-dependent kinase 2(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50121656(CHEMBL3616869)
Affinity DataIC50: 7.83E+4nMAssay Description:Binding affinity to N-terminal His-tagged recombinant human CDK2 (1 to 298 amino acid residues) expressed in Escherichia coli BL21 assessed as inhibi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2016
Entry Details Article
PubMed
TargetCyclin-dependent kinase 2(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50121656(CHEMBL3616869)
Affinity DataIC50: 5.21E+4nMAssay Description:Binding affinity to N-terminal His-tagged recombinant human CDK2 (1 to 298 amino acid residues) expressed in Escherichia coli BL21 assessed as inhibi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2016
Entry Details Article
PubMed