Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Equilibrative nucleoside transporter 1' and Ligand = 'BDBM23652'   

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
Equilibrative nucleoside transporter 1 (Homo sapiens (Human))	BDBM23652 (2-({4,8-bis[bis(3-methylbutyl)amino]-6-[(2-hydroxy...) Show SMILES CC(C)CCN(CCC(C)C)c1nc(NCCO)nc2c(nc(NCCO)nc12)N(CCC(C)C)CCC(C)C Show InChI InChI=1S/C30H56N8O2/c1-21(2)9-15-37(16-10-22(3)4)27-25-26(34-29(35-27)31-13-19-39)28(36-30(33-25)32-14-20-40)38(17-11-23(5)6)18-12-24(7)8/h21-24,39-40H,9-20H2,1-8H3,(H,31,34,35)(H,32,33,36)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center					Assay Description The compounds were tested to determine their ENT1 nucleoside transporter binding ability by a flow cytometric assay using human leukemia K562 cells i...				J Med Chem 50: 3906-20 (2007) Article DOI: 10.1021/jm070311l BindingDB Entry DOI: 10.7270/Q2XK8CVN
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