Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Adenosine kinase' and Ligand = 'BDBM50201830'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Adenosine kinase (Homo sapiens (Human))	BDBM50201830 (CHEMBL387630 | {4-[5-(4-chlorophenyl)-6-morpholin-...) Show SMILES CN(C)c1ccc(cc1)C#Cc1ncnc(N2CCOCC2)c1-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H23ClN4O/c1-28(2)21-10-3-18(4-11-21)5-12-22-23(19-6-8-20(25)9-7-19)24(27-17-26-22)29-13-15-30-16-14-29/h3-4,6-11,17H,13-16H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of cytosolic adenosine kinase				Bioorg Med Chem 15: 1586-605 (2007) Article DOI: 10.1016/j.bmc.2006.12.029 BindingDB Entry DOI: 10.7270/Q2G44PZP
					More data for this Ligand-Target Pair
Adenosine kinase (Homo sapiens (Human))	BDBM50201830 (CHEMBL387630 | {4-[5-(4-chlorophenyl)-6-morpholin-...) Show SMILES CN(C)c1ccc(cc1)C#Cc1ncnc(N2CCOCC2)c1-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H23ClN4O/c1-28(2)21-10-3-18(4-11-21)5-12-22-23(19-6-8-20(25)9-7-19)24(27-17-26-22)29-13-15-30-16-14-29/h3-4,6-11,17H,13-16H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	970	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of adenosine kinase in intact cells assessed as adenosine phosphorylation				Bioorg Med Chem 15: 1586-605 (2007) Article DOI: 10.1016/j.bmc.2006.12.029 BindingDB Entry DOI: 10.7270/Q2G44PZP
					More data for this Ligand-Target Pair