Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with all data for entry = 50033422   

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
Solute carrier family 5 member 4 (Homo sapiens (Human))	BDBM20880 ((2S,3R,4R,5S,6R)-2-{4-chloro-3-[(4-ethoxyphenyl)me...) Show SMILES CCOc1ccc(Cc2cc(ccc2Cl)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 Show InChI InChI=1S/C21H25ClO6/c1-2-27-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)21-20(26)19(25)18(24)17(11-23)28-21/h3-8,10,17-21,23-26H,2,9,11H2,1H3/t17-,18-,19+,20-,21+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.35	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells using methyl-alpha-D-glucopyranoside by liquid scintillation counting				Bioorg Med Chem Lett 21: 3759-63 (2011) Article DOI: 10.1016/j.bmcl.2011.04.063 BindingDB Entry DOI: 10.7270/Q2NC61KM
					More data for this Ligand-Target Pair
Solute carrier family 5 member 4 (Homo sapiens (Human))	BDBM50345019 ((2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-(3-(4-(pent-2...) Show SMILES CC\C=C\COc1ccc(Cc2cccc(c2)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C24H30O6/c1-2-3-4-12-29-19-10-8-16(9-11-19)13-17-6-5-7-18(14-17)24-23(28)22(27)21(26)20(15-25)30-24/h3-11,14,20-28H,2,12-13,15H2,1H3/b4-3+/t20-,21-,22+,23-,24+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	59.5	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells using methyl-alpha-D-glucopyranoside by liquid scintillation counting				Bioorg Med Chem Lett 21: 3759-63 (2011) Article DOI: 10.1016/j.bmcl.2011.04.063 BindingDB Entry DOI: 10.7270/Q2NC61KM
					More data for this Ligand-Target Pair
Solute carrier family 5 member 4 (Homo sapiens (Human))	BDBM50345022 ((2R,3S,4R,5R,6S)-2-Hydroxymethyl-6-(15-oxa-tricycl...) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc2CCCCCCOc3ccc(Cc2c1)cc3 |r| Show InChI InChI=1S/C25H32O6/c26-15-21-22(27)23(28)24(29)25(31-21)18-9-8-17-5-3-1-2-4-12-30-20-10-6-16(7-11-20)13-19(17)14-18/h6-11,14,21-29H,1-5,12-13,15H2/t21-,22-,23+,24-,25+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	81.9	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells using methyl-alpha-D-glucopyranoside by liquid scintillation counting				Bioorg Med Chem Lett 21: 3759-63 (2011) Article DOI: 10.1016/j.bmcl.2011.04.063 BindingDB Entry DOI: 10.7270/Q2NC61KM
					More data for this Ligand-Target Pair
Solute carrier family 5 member 4 (Homo sapiens (Human))	BDBM50345020 ((2R,3S,4R,5R,6S)-2-Hydroxymethyl-6-(15-oxa-tricycl...) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc2CCC\C=C\COc3ccc(Cc2c1)cc3 |r,t:19| Show InChI InChI=1S/C25H30O6/c26-15-21-22(27)23(28)24(29)25(31-21)18-9-8-17-5-3-1-2-4-12-30-20-10-6-16(7-11-20)13-19(17)14-18/h2,4,6-11,14,21-29H,1,3,5,12-13,15H2/b4-2+/t21-,22-,23+,24-,25+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	89.6	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells using methyl-alpha-D-glucopyranoside by liquid scintillation counting				Bioorg Med Chem Lett 21: 3759-63 (2011) Article DOI: 10.1016/j.bmcl.2011.04.063 BindingDB Entry DOI: 10.7270/Q2NC61KM
					More data for this Ligand-Target Pair
Solute carrier family 5 member 4 (Homo sapiens (Human))	BDBM50345023 ((2R,3S,4R,5R,6S)-2-Hydroxymethyl-6-(16-oxa-tricycl...) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc2CCCCCCCOc3ccc(Cc2c1)cc3 |r| Show InChI InChI=1S/C26H34O6/c27-16-22-23(28)24(29)25(30)26(32-22)19-10-9-18-6-4-2-1-3-5-13-31-21-11-7-17(8-12-21)14-20(18)15-19/h7-12,15,22-30H,1-6,13-14,16H2/t22-,23-,24+,25-,26+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	99.7	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells using methyl-alpha-D-glucopyranoside by liquid scintillation counting				Bioorg Med Chem Lett 21: 3759-63 (2011) Article DOI: 10.1016/j.bmcl.2011.04.063 BindingDB Entry DOI: 10.7270/Q2NC61KM
					More data for this Ligand-Target Pair
Solute carrier family 5 member 4 (Homo sapiens (Human))	BDBM50345021 ((2R,3S,4R,5R,6S)-2-Hydroxymethyl-6-(16-oxa-tricycl...) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc2CCCC\C=C\COc3ccc(Cc2c1)cc3 |r,t:20| Show InChI InChI=1S/C26H32O6/c27-16-22-23(28)24(29)25(30)26(32-22)19-10-9-18-6-4-2-1-3-5-13-31-21-11-7-17(8-12-21)14-20(18)15-19/h3,5,7-12,15,22-30H,1-2,4,6,13-14,16H2/b5-3+/t22-,23-,24+,25-,26+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Inhibition of human SGLT2 expressed in CHO cells using methyl-alpha-D-glucopyranoside by liquid scintillation counting				Bioorg Med Chem Lett 21: 3759-63 (2011) Article DOI: 10.1016/j.bmcl.2011.04.063 BindingDB Entry DOI: 10.7270/Q2NC61KM
					More data for this Ligand-Target Pair