Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Equilibrative nucleoside transporter 1' and Ligand = 'BDBM50301066'   

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))	BDBM50301066 (CHEMBL571939 | N-(6-(2-(((2S,3S,4R,5R)-3,4-dihydro...) Show SMILES O[C@@H]1[C@@H](CSCCNC(=O)CCCCCNC(=O)c2cccc(I)c2)O[C@H]([C@@H]1O)n1cnc2c(NCc3ccc(cc3)[N+]([O-])=O)ncnc12 |r| Show InChI InChI=1S/C32H37IN8O7S/c33-22-6-4-5-21(15-22)31(45)35-12-3-1-2-7-25(42)34-13-14-49-17-24-27(43)28(44)32(48-24)40-19-39-26-29(37-18-38-30(26)40)36-16-20-8-10-23(11-9-20)41(46)47/h4-6,8-11,15,18-19,24,27-28,32,43-44H,1-3,7,12-14,16-17H2,(H,34,42)(H,35,45)(H,36,37,38)/t24-,27-,28-,32-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ulm University Curated by ChEMBL					Assay Description Displacement of SAENTA-fluorescein from human ENT1 in HL60 cells by flow cytometry				Bioorg Med Chem Lett 19: 5151-4 (2009) Article DOI: 10.1016/j.bmcl.2009.07.017 BindingDB Entry DOI: 10.7270/Q2QJ7HCF
					More data for this Ligand-Target Pair
Equilibrative nucleoside transporter 1 (Homo sapiens (Human))	BDBM50301066 (CHEMBL571939 | N-(6-(2-(((2S,3S,4R,5R)-3,4-dihydro...) Show SMILES O[C@@H]1[C@@H](CSCCNC(=O)CCCCCNC(=O)c2cccc(I)c2)O[C@H]([C@@H]1O)n1cnc2c(NCc3ccc(cc3)[N+]([O-])=O)ncnc12 |r| Show InChI InChI=1S/C32H37IN8O7S/c33-22-6-4-5-21(15-22)31(45)35-12-3-1-2-7-25(42)34-13-14-49-17-24-27(43)28(44)32(48-24)40-19-39-26-29(37-18-38-30(26)40)36-16-20-8-10-23(11-9-20)41(46)47/h4-6,8-11,15,18-19,24,27-28,32,43-44H,1-3,7,12-14,16-17H2,(H,34,42)(H,35,45)(H,36,37,38)/t24-,27-,28-,32-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Ulm University Curated by ChEMBL					Assay Description Displacement of SAENTA-fluorescein from human ENT1 in HL60 cells by flow cytometry				Bioorg Med Chem Lett 19: 5151-4 (2009) Article DOI: 10.1016/j.bmcl.2009.07.017 BindingDB Entry DOI: 10.7270/Q2QJ7HCF
					More data for this Ligand-Target Pair