BDBM7126 3-Propylaminopyrazole deriv. 3::CHEMBL112442::CS2::N-(5-Cyclopropyl-1H-pyrazol-3-yl)butanamide

SMILES CCCC(=O)Nc1cc([nH]n1)C1CC1

InChI Key InChIKey=KPQLRNNPRYBTLP-UHFFFAOYSA-N

Data  2 IC50  7 Kd  2 Koff  2 Kon  2 ITC

  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 3 hits for monomerid = 7126   

TargetCyclin-dependent kinase 2(Homo sapiens (Human))
D3R/Abbott

LigandPNGBDBM7126(3-Propylaminopyrazole deriv. 3 | CHEMBL112442 | CS...)
Affinity DataKoff:  4.68E+6s-1Assay Description:OctetRed_Method3More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
D3R/Abbott

LigandPNGBDBM7126(3-Propylaminopyrazole deriv. 3 | CHEMBL112442 | CS...)
Affinity DataKon:  1.04M-1s-1Assay Description:OctetRed_Method3More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
D3R/Abbott

LigandPNGBDBM7126(3-Propylaminopyrazole deriv. 3 | CHEMBL112442 | CS...)
Affinity DataKd:  360nMAssay Description:OctetRed_Method2More data for this Ligand-Target Pair
In DepthDetails PubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 7126   

CellCyclin-dependent kinase 2(Homo sapiens (Human))
D3R/Abbott

SyringePNGBDBM7126(3-Propylaminopyrazole deriv. 3 | CHEMBL112442 | CS...)
ITC DataΔG°: -8.55kcal/mole −TΔS°: 1.64kcal/mole ΔH°: -10.2kcal/mole logk: 1.89E+6
T: 24.85°C 
In DepthDetails PubMed