Compile Data Set for Download or QSAR

Found 235 hits with Last Name = 'martinez' and Initial = 'y'   

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
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50171394 (2-Decyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine | CH...) Show SMILES CCCCCCCCCCn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C15H25N5/c1-2-3-4-5-6-7-8-9-10-20-11-13-14(16)17-12-18-15(13)19-20/h11-12H,2-10H2,1H3,(H2,16,17,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50171396 (1-((R)-4-Amino-pyrazolo[3,4-d]pyrimidin-2-yl)-deca...) Show SMILES CCCCCCCCC(O)Cn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C15H25N5O/c1-2-3-4-5-6-7-8-12(21)9-20-10-13-14(16)17-11-18-15(13)19-20/h10-12,21H,2-9H2,1H3,(H2,16,17,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.280	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50213599 ((6aR,10aR)-3-(6-bromo-2-methylhexan-2-yl)-6,6,9-tr...) Show SMILES CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(cc1OC2(C)C)C(C)(C)CCCCBr |t:1| Show InChI InChI=1S/C23H33BrO2/c1-15-8-9-18-17(12-15)21-19(25)13-16(14-20(21)26-23(18,4)5)22(2,3)10-6-7-11-24/h8,13-14,17-18,25H,6-7,9-12H2,1-5H3/t17-,18-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50171395 (2-Undecyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine | ...) Show SMILES CCCCCCCCCCCn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C16H27N5/c1-2-3-4-5-6-7-8-9-10-11-21-12-14-15(17)18-13-19-16(14)20-21/h12-13H,2-11H2,1H3,(H2,17,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.470	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337798 ((6aR,10aR)-3-(8-bromo-2-methyloctan-2-yl)-6,6,9-tr...) Show SMILES CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(cc1OC2(C)C)C(C)(C)CCCCCCBr |r,t:1| Show InChI InChI=1S/C25H37BrO2/c1-17-10-11-20-19(14-17)23-21(27)15-18(16-22(23)28-25(20,4)5)24(2,3)12-8-6-7-9-13-26/h10,15-16,19-20,27H,6-9,11-14H2,1-5H3/t19-,20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50171393 (2-Nonyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine | CH...) Show SMILES CCCCCCCCCn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C14H23N5/c1-2-3-4-5-6-7-8-9-19-10-12-13(15)16-11-17-14(12)18-19/h10-11H,2-9H2,1H3,(H2,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337797 ((6aR,10aR)-3-(5-bromopentyl)-6,6,9-trimethyl-6a,7,...) Show SMILES CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CCCCCBr)cc1OC2(C)C |r,t:1| Show InChI InChI=1S/C21H29BrO2/c1-14-8-9-17-16(11-14)20-18(23)12-15(7-5-4-6-10-22)13-19(20)24-21(17,2)3/h8,12-13,16-17,23H,4-7,9-11H2,1-3H3/t16-,17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50402202 (CHEMBL2203964) Show SMILES COCCCn1ccc2cc(cnc12)-c1cc(cc(=O)n1O)-c1ccccc1 Show InChI InChI=1S/C22H21N3O3/c1-28-11-5-9-24-10-8-17-12-19(15-23-22(17)24)20-13-18(14-21(26)25(20)27)16-6-3-2-4-7-16/h2-4,6-8,10,12-15,27H,5,9,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human GLO1				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair				3D Structure (crystal)
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50092825 (CHEMBL128935 | S-(N-phenyl-N-hydroxycarbamoyl)glut...) Show SMILES N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccccc1)C(=O)NCC(O)=O)C(O)=O Show InChI InChI=1S/C17H22N4O8S/c18-11(16(26)27)6-7-13(22)20-12(15(25)19-8-14(23)24)9-30-17(28)21(29)10-4-2-1-3-5-10/h1-5,11-12,29H,6-9,18H2,(H,19,25)(H,20,22)(H,23,24)(H,26,27)/t11-,12-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human GLO1				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337796 ((6aR,10aR)-3-(4-bromobutyl)-6,6,9-trimethyl-6a,7,1...) Show SMILES CC1=C[C@@H]2[C@@H](CC1)C(C)(C)Oc1cc(CCCCBr)cc(O)c21 |r,t:1| Show InChI InChI=1S/C20H27BrO2/c1-13-7-8-16-15(10-13)19-17(22)11-14(6-4-5-9-21)12-18(19)23-20(16,2)3/h10-12,15-16,22H,4-9H2,1-3H3/t15-,16-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337799 ((6aR,10aR)-6,6,9-trimethyl-3-(5,5,5-trifluoropenty...) Show SMILES CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CCCCC(F)(F)F)cc1OC2(C)C |r,t:1| Show InChI InChI=1S/C21H27F3O2/c1-13-7-8-16-15(10-13)19-17(25)11-14(6-4-5-9-21(22,23)24)12-18(19)26-20(16,2)3/h7,11-12,15-16,25H,4-6,8-10H2,1-3H3/t15-,16-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337803 (3-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-2-yl)nonan-...) Show SMILES CCCCCCC(C(C)O)n1cc2c(N)ncnc2n1 Show InChI InChI=1S/C14H23N5O/c1-3-4-5-6-7-12(10(2)20)19-8-11-13(15)16-9-17-14(11)18-19/h8-10,12,20H,3-7H2,1-2H3,(H2,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337800 ((6aR,10aR)-9-(fluoromethyl)-6,6-dimethyl-3-pentyl-...) Show SMILES CCCCCc1cc(O)c2[C@@H]3CC(CF)=CC[C@H]3C(C)(C)Oc2c1 |r,c:14| Show InChI InChI=1S/C21H29FO2/c1-4-5-6-7-14-11-18(23)20-16-10-15(13-22)8-9-17(16)21(2,3)24-19(20)12-14/h8,11-12,16-17,23H,4-7,9-10,13H2,1-3H3/t16-,17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	103	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517464 (CHEMBL1234300) Show SMILES COC(=O)c1c(C)cc(Oc2cc(C)cc(O)c2O)cc1O Show InChI InChI=1S/C16H16O6/c1-8-4-12(18)15(19)13(5-8)22-10-6-9(2)14(11(17)7-10)16(20)21-3/h4-7,17-19H,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human GLO1				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair				3D Structure (crystal)
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337795 ((6aR,10aR)-6,6,9-trimethyl-3-(octan-2-yl)-6a,7,10,...) Show SMILES CCCCCCC(C)c1cc(O)c2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1 |r,c:16| Show InChI InChI=1S/C24H36O2/c1-6-7-8-9-10-17(3)18-14-21(25)23-19-13-16(2)11-12-20(19)24(4,5)26-22(23)15-18/h11,14-15,17,19-20,25H,6-10,12-13H2,1-5H3/t17?,19-,20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	328	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50171387 (2-Octyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine | CH...) Show SMILES CCCCCCCCn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C13H21N5/c1-2-3-4-5-6-7-8-18-9-11-12(14)15-10-16-13(11)17-18/h9-10H,2-8H2,1H3,(H2,14,15,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	530	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50171391 (2-Heptyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine | C...) Show SMILES CCCCCCCn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C12H19N5/c1-2-3-4-5-6-7-17-8-10-11(13)14-9-15-12(10)16-17/h8-9H,2-7H2,1H3,(H2,13,14,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	818	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337801 (2-Hexyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine | 2-...) Show SMILES CCCCCCn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C11H17N5/c1-2-3-4-5-6-16-7-9-10(12)13-8-14-11(9)15-16/h7-8H,2-6H2,1H3,(H2,12,13,14,15)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337802 (2-Dodecyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine | ...) Show SMILES CCCCCCCCCCCCn1cc2c(N)ncnc2n1 Show InChI InChI=1S/C17H29N5/c1-2-3-4-5-6-7-8-9-10-11-12-22-13-15-16(18)19-14-20-17(15)21-22/h13-14H,2-12H2,1H3,(H2,18,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50337804 (5-(7-(benzyloxy)quinazolin-4-ylamino)-4-fluoro-2-m...) Show SMILES Cc1cc(F)c(Nc2ncnc3cc(OCc4ccccc4)ccc23)cc1O Show InChI InChI=1S/C22H18FN3O2/c1-14-9-18(23)20(11-21(14)27)26-22-17-8-7-16(10-19(17)24-13-25-22)28-12-15-5-3-2-4-6-15/h2-11,13,27H,12H2,1H3,(H,24,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption by ELISA assay in presence of 20 uM ATP				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM5432 (6-(4-methoxyphenyl)-3-(thiophen-3-yl)pyrazolo[1,5-...) Show SMILES COc1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccsc1 Show InChI InChI=1S/C17H13N3OS/c1-21-15-4-2-12(3-5-15)14-8-18-17-16(9-19-20(17)10-14)13-6-7-22-11-13/h2-11H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption by ELISA assay in presence of 20 uM ATP				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Homo sapiens (Human))	BDBM50222276 (6,7-dihydroxy-4'-methoxyisoflavan | CHEMBL239247) Show SMILES COc1ccc(cc1)C1COc2cc(O)c(O)cc2C1 |w:8.8| Show InChI InChI=1S/C16H16O4/c1-19-13-4-2-10(3-5-13)12-6-11-7-14(17)15(18)8-16(11)20-9-12/h2-5,7-8,12,17-18H,6,9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 15-hLO1				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Homo sapiens (Human))	BDBM50222277 (6,7-dihydroxy-3'-methylisoflavan | CHEMBL239893) Show SMILES Cc1cccc(c1)C1COc2cc(O)c(O)cc2C1 |w:7.7| Show InChI InChI=1S/C16H16O3/c1-10-3-2-4-11(5-10)13-6-12-7-14(17)15(18)8-16(12)19-9-13/h2-5,7-8,13,17-18H,6,9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 15-hLO1				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Homo sapiens (Human))	BDBM50222295 (6,7-dihydroxy-3-m-tolyl-2,3-dihydrochromen-4-one |...) Show SMILES Cc1cccc(c1)C1COc2cc(O)c(O)cc2C1=O Show InChI InChI=1S/C16H14O4/c1-9-3-2-4-10(5-9)12-8-20-15-7-14(18)13(17)6-11(15)16(12)19/h2-7,12,17-18H,8H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 15-hLO1				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Homo sapiens (Human))	BDBM32020 (4-[4-(3,4-dihydroxyphenyl)-2,3-dimethyl-butyl]pyro...) Show SMILES CC(Cc1ccc(O)c(O)c1)C(C)Cc1ccc(O)c(O)c1 Show InChI InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 15-hLO1				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Homo sapiens (Human))	BDBM50222307 (6,7-dihydroxy-3',4'-methylenedioxyisoflavan | CHEM...) Show SMILES Oc1cc2CC(COc2cc1O)c1ccc2OCOc2c1 |w:5.13| Show InChI InChI=1S/C16H14O5/c17-12-4-10-3-11(7-19-15(10)6-13(12)18)9-1-2-14-16(5-9)21-8-20-14/h1-2,4-6,11,17-18H,3,7-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 15-hLO1				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517468 (CHEMBL4559294) Show SMILES Clc1cccc(c1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C20H14ClN3O2S/c21-15-6-3-5-14(13-15)16-9-10-18(20-17(16)7-4-12-23-20)24-27(25,26)19-8-1-2-11-22-19/h1-13,24H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX12 (Homo sapiens (Human))	BDBM7460 (2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...) Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 12-hLO				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517488 (CHEMBL4516514) Show SMILES COc1cc(CCc2cc(NS(=O)(=O)c3ccccn3)c3ncccc3c2)cc(OC)c1 Show InChI InChI=1S/C24H23N3O4S/c1-30-20-13-18(14-21(16-20)31-2)9-8-17-12-19-6-5-11-26-24(19)22(15-17)27-32(28,29)23-7-3-4-10-25-23/h3-7,10-16,27H,8-9H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517469 (CHEMBL4543065) Show SMILES Clc1ccc(cc1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C20H14ClN3O2S/c21-15-8-6-14(7-9-15)16-10-11-18(20-17(16)4-3-13-23-20)24-27(25,26)19-5-1-2-12-22-19/h1-13,24H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX12 (Homo sapiens (Human))	BDBM50222293 (4'-chloro-7,8-dihydroxyisoflavone | CHEMBL241814) Show SMILES Oc1ccc2c(occ(-c3ccc(Cl)cc3)c2=O)c1O Show InChI InChI=1S/C15H9ClO4/c16-9-3-1-8(2-4-9)11-7-20-15-10(13(11)18)5-6-12(17)14(15)19/h1-7,17,19H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 12-hLO				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517474 (CHEMBL4539074) Show SMILES O=S(=O)(Nc1ccc(-c2ccccc2)c2cccnc12)c1ccccn1 Show InChI InChI=1S/C20H15N3O2S/c24-26(25,19-10-4-5-13-21-19)23-18-12-11-16(15-7-2-1-3-8-15)17-9-6-14-22-20(17)18/h1-14,23H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Homo sapiens (Human))	BDBM50139862 (3-(4-Hydroxy-phenyl)-chroman-6,7-diol | 4',6,7-tri...) Show SMILES Oc1ccc(cc1)C1COc2cc(O)c(O)cc2C1 Show InChI InChI=1S/C15H14O4/c16-12-3-1-9(2-4-12)11-5-10-6-13(17)14(18)7-15(10)19-8-11/h1-4,6-7,11,16-18H,5,8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 15-hLO1				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517465 (CHEMBL4457949) Show SMILES Clc1ccc(cc1Cl)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C20H13Cl2N3O2S/c21-16-8-6-13(12-17(16)22)14-7-9-18(20-15(14)4-3-11-24-20)25-28(26,27)19-5-1-2-10-23-19/h1-12,25H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517466 (CHEMBL4571524) Show SMILES COc1ccc(cc1Cl)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C21H16ClN3O3S/c1-28-19-10-7-14(13-17(19)22)15-8-9-18(21-16(15)5-4-12-24-21)25-29(26,27)20-6-2-3-11-23-20/h2-13,25H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX12 (Homo sapiens (Human))	BDBM50222308 (7,8-dihydroxy-30-trifluoromethylisoflavone | CHEMB...) Show SMILES Oc1ccc2c(occ(-c3cccc(c3)C(F)(F)F)c2=O)c1O Show InChI InChI=1S/C16H9F3O4/c17-16(18,19)9-3-1-2-8(6-9)11-7-23-15-10(13(11)21)4-5-12(20)14(15)22/h1-7,20,22H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 12-hLO				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517473 (CHEMBL4573731) Show SMILES COc1ccc(cc1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C21H17N3O3S/c1-27-16-9-7-15(8-10-16)17-11-12-19(21-18(17)5-4-14-23-21)24-28(25,26)20-6-2-3-13-22-20/h2-14,24H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517471 (CHEMBL4466017) Show SMILES Fc1ccc(cc1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C20H14FN3O2S/c21-15-8-6-14(7-9-15)16-10-11-18(20-17(16)4-3-13-23-20)24-27(25,26)19-5-1-2-12-22-19/h1-13,24H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX12 (Homo sapiens (Human))	BDBM50222290 (3'-chloro-7,8-dihydroxyisoflavone | CHEMBL241815 |...) Show SMILES Oc1ccc2c(occ(-c3cccc(Cl)c3)c2=O)c1O Show InChI InChI=1S/C15H9ClO4/c16-9-3-1-2-8(6-9)11-7-20-15-10(13(11)18)4-5-12(17)14(15)19/h1-7,17,19H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	780	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 12-hLO				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517437 (CHEMBL4514413) Show SMILES O=S(=O)(Nc1ccc(CCc2ccccc2)c2cccnc12)c1ccccn1 Show InChI InChI=1S/C22H19N3O2S/c26-28(27,21-10-4-5-15-23-21)25-20-14-13-18(19-9-6-16-24-22(19)20)12-11-17-7-2-1-3-8-17/h1-10,13-16,25H,11-12H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517463 (CHEMBL4532036) Show SMILES Fc1ccc(CCc2ccc(NS(=O)(=O)c3ccccn3)c3ncccc23)cc1 Show InChI InChI=1S/C22H18FN3O2S/c23-18-11-7-16(8-12-18)6-9-17-10-13-20(22-19(17)4-3-15-25-22)26-29(27,28)21-5-1-2-14-24-21/h1-5,7-8,10-15,26H,6,9H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM4620 (Anilinoquinazoline deriv. 3 | N-(4-chlorophenyl)-6...) Show SMILES COc1cc2ncnc(Nc3ccc(Cl)cc3)c2cc1OC Show InChI InChI=1S/C16H14ClN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-10(17)4-6-11/h3-9H,1-2H3,(H,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Chaminade University of Honolulu Curated by ChEMBL					Assay Description Inhibition of human recombinant His-tagged VEGFR2 assessed as infrared absorption by ELISA assay in presence of 20 uM ATP				Bioorg Med Chem Lett 21: 1371-5 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2011.01.037 BindingDB Entry DOI: 10.7270/Q21J9B1F
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX12 (Homo sapiens (Human))	BDBM50009001 (5,6,7-Trihydroxyflavone | 5,6,7-trihydroxy-2-pheny...) Show SMILES Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccccc1 Show InChI InChI=1S/C15H10O5/c16-9-6-11(8-4-2-1-3-5-8)20-12-7-10(17)14(18)15(19)13(9)12/h1-7,17-19H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	860	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 12-hLO				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX12 (Homo sapiens (Human))	BDBM7457 (2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-4H-chromen-4...) Show SMILES Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O Show InChI InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 12-hLO				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517467 (CHEMBL4580349) Show SMILES COc1cccc(c1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C21H17N3O3S/c1-27-16-7-4-6-15(14-16)17-10-11-19(21-18(17)8-5-13-23-21)24-28(25,26)20-9-2-3-12-22-20/h2-14,24H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517461 (CHEMBL4575972) Show SMILES COc1cc(OC)cc(c1)-c1ccc(NS(=O)(=O)c2ccccn2)c2ncccc12 Show InChI InChI=1S/C22H19N3O4S/c1-28-16-12-15(13-17(14-16)29-2)18-8-9-20(22-19(18)6-5-11-24-22)25-30(26,27)21-7-3-4-10-23-21/h3-14,25H,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517462 (CHEMBL4467660) Show SMILES O=S(=O)(Nc1cc(CCc2ccccc2)cc2cccnc12)c1ccccn1 Show InChI InChI=1S/C22H19N3O2S/c26-28(27,21-10-4-5-13-23-21)25-20-16-18(12-11-17-7-2-1-3-8-17)15-19-9-6-14-24-22(19)20/h1-10,13-16,25H,11-12H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517483 (CHEMBL3981698) Show SMILES O=S(=O)(Nc1cccc2cccnc12)c1ccccn1 Show InChI InChI=1S/C14H11N3O2S/c18-20(19,13-8-1-2-9-15-13)17-12-7-3-5-11-6-4-10-16-14(11)12/h1-10,17H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Lactoylglutathione lyase (Homo sapiens (Human))	BDBM50517489 (CHEMBL4454726) Show SMILES Fc1ccc(CCc2cc(NS(=O)(=O)c3ccccn3)c3ncccc3c2)cc1 Show InChI InChI=1S/C22H18FN3O2S/c23-19-10-8-16(9-11-19)6-7-17-14-18-4-3-13-25-22(18)20(15-17)26-29(27,28)21-5-1-2-12-24-21/h1-5,8-15,26H,6-7H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition recombinant human N-terminal 6His-tagged GLO1 (2 to 184 residues) expressed in Escherichia coli using MG as substrate preincubated for 15 ...				J Med Chem 62: 1609-1625 (2019) Article DOI: 10.1021/acs.jmedchem.8b01868 BindingDB Entry DOI: 10.7270/Q2251NJC
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Homo sapiens (Human))	BDBM7457 (2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-4H-chromen-4...) Show SMILES Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O Show InChI InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Santiago de Chile Curated by ChEMBL					Assay Description Inhibition of 15-hLO1				Bioorg Med Chem 15: 7408-25 (2007) Article DOI: 10.1016/j.bmc.2007.07.036 BindingDB Entry DOI: 10.7270/Q2RN37KN
					More data for this Ligand-Target Pair

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