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SMILES: Fc1cccc(F)c1C(=O)Nc1c[nH]nc1C(=O)NC1CCCCC1

InChI Key: InChIKey=GJHVXBPCYTULDM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50368878   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))		BDBM50368878
PNG
(CHEMBL456963)
Show SMILES Fc1cccc(F)c1C(=O)Nc1c[nH]nc1C(=O)NC1CCCCC1
Show InChI InChI=1S/C17H18F2N4O2/c18-11-7-4-8-12(19)14(11)16(24)22-13-9-20-23-15(13)17(25)21-10-5-2-1-3-6-10/h4,7-10H,1-3,5-6H2,(H,20,23)(H,21,25)(H,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

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Similars
Article
PubMed
n/an/a 12n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of C-terminal His6-tagged human full length CDK2/N-terminal GST-tagged human full length Cyclin A using histone H1 and [gamma-32P]-ATP inc...

J Med Chem 61: 7700-7709 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00669
BindingDB Entry DOI: 10.7270/Q2GX4F3H
More data for this
Ligand-Target Pair