BDBM50056177 2-[6-Benzylamino-2-(2-hydroxy-ethylamino)-purin-9-yl]-ethanol::CHEMBL130681

SMILES: OCCNc1nc(NCc2ccccc2)c2ncn(CCO)c2n1

InChI Key: InChIKey=OXAOTDWDDSZSNQ-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50056177   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50056177 (2-[6-Benzylamino-2-(2-hydroxy-ethylamino)-purin-9-...) Show SMILES OCCNc1nc(NCc2ccccc2)c2ncn(CCO)c2n1 Show InChI InChI=1S/C16H20N6O2/c23-8-6-17-16-20-14(18-10-12-4-2-1-3-5-12)13-15(21-16)22(7-9-24)11-19-13/h1-5,11,23-24H,6-10H2,(H2,17,18,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Charles University Curated by ChEMBL					Assay Description Inhibitory activity against purified cdc2 p34/Cyclin B obtained from M phase oocytes of the starfish Marthasterias glacialis.				J Med Chem 40: 408-12 (1997) Article DOI: 10.1021/jm960666x BindingDB Entry DOI: 10.7270/Q2GF0SNG
					More data for this Ligand-Target Pair