Compile Data Set for Download or QSAR

Found 27 hits with Last Name = 'silva' and Initial = 'fp'   

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
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM92367 (GPESB15) Show SMILES O[C@@H]1O[C@H](Cn2cc(nn2)C2=CCCCC2)[C@H](O)C1O |r,t:11| Show InChI InChI=1S/C13H19N3O4/c17-11-10(20-13(19)12(11)18)7-16-6-9(14-15-16)8-4-2-1-3-5-8/h4,6,10-13,17-19H,1-3,5,7H2/t10-,11+,12?,13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3.36E+4	-26.6	3.58E+4	n/a	n/a	n/a	n/a	7.0	37
Yonsei University					Assay Description To test whether GCTs share a common binding pocket on PPA with acarbose, we performed an experiment according to the method of Yonetani and Theorell.				Chembiochem 13: 1584-93 (2012) Article DOI: 10.1002/cbic.201200272 BindingDB Entry DOI: 10.7270/Q2ST7NFC
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM92366 (GPESB14) Show SMILES O[C@@H]1O[C@H](Cn2cc(nn2)-c2ccccc2)[C@H](O)C1O |r| Show InChI InChI=1S/C13H15N3O4/c17-11-10(20-13(19)12(11)18)7-16-6-9(14-15-16)8-4-2-1-3-5-8/h1-6,10-13,17-19H,7H2/t10-,11+,12?,13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.04E+5	-21.9	8.89E+4	n/a	n/a	n/a	n/a	7.0	37
Yonsei University					Assay Description To test whether GCTs share a common binding pocket on PPA with acarbose, we performed an experiment according to the method of Yonetani and Theorell.				Chembiochem 13: 1584-93 (2012) Article DOI: 10.1002/cbic.201200272 BindingDB Entry DOI: 10.7270/Q2ST7NFC
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM92365 (GPESB11) Show SMILES CO[C@@H]1O[C@H](Cn2cc(COC(C)=O)nn2)[C@@H]2OC(C)(C)OC12 |r| Show InChI InChI=1S/C14H21N3O6/c1-8(18)20-7-9-5-17(16-15-9)6-10-11-12(13(19-4)21-10)23-14(2,3)22-11/h5,10-13H,6-7H2,1-4H3/t10-,11+,12?,13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.34E+5	-21.6	1.25E+5	n/a	n/a	n/a	n/a	7.0	37
Yonsei University					Assay Description To test whether GCTs share a common binding pocket on PPA with acarbose, we performed an experiment according to the method of Yonetani and Theorell.				Chembiochem 13: 1584-93 (2012) Article DOI: 10.1002/cbic.201200272 BindingDB Entry DOI: 10.7270/Q2ST7NFC
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM92363 (GPESB02) Show SMILES CO[C@@H]1O[C@H](Cn2cc(nn2)C2=CCCCC2)[C@@H]2OC(C)(C)OC12 |r,t:12| Show InChI InChI=1S/C17H25N3O4/c1-17(2)23-14-13(22-16(21-3)15(14)24-17)10-20-9-12(18-19-20)11-7-5-4-6-8-11/h7,9,13-16H,4-6,8,10H2,1-3H3/t13-,14+,15?,16-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3.42E+5	-20.6	1.50E+5	n/a	n/a	n/a	n/a	7.0	37
Yonsei University					Assay Description To test whether GCTs share a common binding pocket on PPA with acarbose, we performed an experiment according to the method of Yonetani and Theorell.				Chembiochem 13: 1584-93 (2012) Article DOI: 10.1002/cbic.201200272 BindingDB Entry DOI: 10.7270/Q2ST7NFC
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM92362 (GPESB01) Show SMILES CO[C@@H]1O[C@H](Cn2cc(nn2)-c2ccccc2)[C@@H]2OC(C)(C)OC12 |r| Show InChI InChI=1S/C17H21N3O4/c1-17(2)23-14-13(22-16(21-3)15(14)24-17)10-20-9-12(18-19-20)11-7-5-4-6-8-11/h4-9,13-16H,10H2,1-3H3/t13-,14+,15?,16-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	7.80E+5	-18.5	3.61E+5	n/a	n/a	n/a	n/a	7.0	37
Yonsei University					Assay Description To test whether GCTs share a common binding pocket on PPA with acarbose, we performed an experiment according to the method of Yonetani and Theorell.				Chembiochem 13: 1584-93 (2012) Article DOI: 10.1002/cbic.201200272 BindingDB Entry DOI: 10.7270/Q2ST7NFC
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM92364 (GPESB07) Show SMILES CO[C@@H]1O[C@H](Cn2cc(nn2)C2(O)CCCCC2)[C@@H]2OC(C)(C)OC12 |r| Show InChI InChI=1S/C17H27N3O5/c1-16(2)24-13-11(23-15(22-3)14(13)25-16)9-20-10-12(18-19-20)17(21)7-5-4-6-8-17/h10-11,13-15,21H,4-9H2,1-3H3/t11-,13+,14?,15-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.01E+6	-17.8	3.56E+5	n/a	n/a	n/a	n/a	7.0	37
Yonsei University					Assay Description To test whether GCTs share a common binding pocket on PPA with acarbose, we performed an experiment according to the method of Yonetani and Theorell.				Chembiochem 13: 1584-93 (2012) Article DOI: 10.1002/cbic.201200272 BindingDB Entry DOI: 10.7270/Q2ST7NFC
					More data for this Ligand-Target Pair
Thioredoxin glutathione reductase (Schistosoma mansoni)	BDBM50532918 (CHEMBL1325877) Show SMILES COc1ccc(cc1)C(=O)c1no[n+]([O-])c1C(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C18H14N2O6/c1-24-13-7-3-11(4-8-13)17(21)15-16(20(23)26-19-15)18(22)12-5-9-14(25-2)10-6-12/h3-10H,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni TGR				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Thioredoxin glutathione reductase (Schistosoma mansoni)	BDBM50532918 (CHEMBL1325877) Show SMILES COc1ccc(cc1)C(=O)c1no[n+]([O-])c1C(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C18H14N2O6/c1-24-13-7-3-11(4-8-13)17(21)15-16(20(23)26-19-15)18(22)12-5-9-14(25-2)10-6-12/h3-10H,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni TGR				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM50308256 (1-O-Methyl-2,3-O-isopropylidene-5-(4-cyclohexene-1...) Show SMILES CO[C@@H]1O[C@H](Cn2cc(nn2)C2=CCCCC2)[C@H]2OC(C)(C)O[C@@H]12 |r,t:12| Show InChI InChI=1S/C17H25N3O4/c1-17(2)23-14-13(22-16(21-3)15(14)24-17)10-20-9-12(18-19-20)11-7-5-4-6-8-11/h7,9,13-16H,4-6,8,10H2,1-3H3/t13-,14-,15-,16-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase MAL12 assessed as inhibition of p-nitrophenol release by spectrophotometry				J Med Chem 53: 2364-75 (2010) Article DOI: 10.1021/jm901265h BindingDB Entry DOI: 10.7270/Q20R9QC7
					More data for this Ligand-Target Pair
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM50308259 (1-O-Methyl-2,3-O-isopropylidene-5-[4-(1-hydroxycyc...) Show SMILES CO[C@@H]1O[C@H](Cn2cc(nn2)C2(O)CCCCC2)[C@H]2OC(C)(C)O[C@@H]12 |r| Show InChI InChI=1S/C17H27N3O5/c1-16(2)24-13-11(23-15(22-3)14(13)25-16)9-20-10-12(18-19-20)17(21)7-5-4-6-8-17/h10-11,13-15,21H,4-9H2,1-3H3/t11-,13-,14-,15-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase MAL12 assessed as inhibition of p-nitrophenol release by spectrophotometry				J Med Chem 53: 2364-75 (2010) Article DOI: 10.1021/jm901265h BindingDB Entry DOI: 10.7270/Q20R9QC7
					More data for this Ligand-Target Pair
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM50308258 (1-O-Methyl-2,3-O-isopropylidene-5-(4-phenoxymethyl...) Show SMILES CO[C@@H]1O[C@H](Cn2cc(COc3ccccc3)nn2)[C@H]2OC(C)(C)O[C@@H]12 |r| Show InChI InChI=1S/C18H23N3O5/c1-18(2)25-15-14(24-17(22-3)16(15)26-18)10-21-9-12(19-20-21)11-23-13-7-5-4-6-8-13/h4-9,14-17H,10-11H2,1-3H3/t14-,15-,16-,17-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase MAL12 assessed as inhibition of p-nitrophenol release by spectrophotometry				J Med Chem 53: 2364-75 (2010) Article DOI: 10.1021/jm901265h BindingDB Entry DOI: 10.7270/Q20R9QC7
					More data for this Ligand-Target Pair
Thioredoxin glutathione reductase (Schistosoma mansoni)	BDBM47913 (MLS001030320 | N-(4-nitro-1,2,5-oxadiazol-3-yl)-2-...) Show SMILES [O-][N+](=O)c1nonc1NC(=O)CSc1ccccn1 Show InChI InChI=1S/C9H7N5O4S/c15-6(5-19-7-3-1-2-4-10-7)11-8-9(14(16)17)13-18-12-8/h1-4H,5H2,(H,11,12,15)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni TGR				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Thioredoxin glutathione reductase (Schistosoma mansoni)	BDBM47913 (MLS001030320 | N-(4-nitro-1,2,5-oxadiazol-3-yl)-2-...) Show SMILES [O-][N+](=O)c1nonc1NC(=O)CSc1ccccn1 Show InChI InChI=1S/C9H7N5O4S/c15-6(5-19-7-3-1-2-4-10-7)11-8-9(14(16)17)13-18-12-8/h1-4H,5H2,(H,11,12,15)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni TGR				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM50308255 (1-O-Methyl-2,3-O-isopropylidene-5-(4-phenyl-1H-1,2...) Show SMILES CO[C@@H]1O[C@H](Cn2cc(nn2)-c2ccccc2)[C@H]2OC(C)(C)O[C@@H]12 |r| Show InChI InChI=1S/C17H21N3O4/c1-17(2)23-14-13(22-16(21-3)15(14)24-17)10-20-9-12(18-19-20)11-7-5-4-6-8-11/h4-9,13-16H,10H2,1-3H3/t13-,14-,15-,16-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.49E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase MAL12 assessed as inhibition of p-nitrophenol release by spectrophotometry				J Med Chem 53: 2364-75 (2010) Article DOI: 10.1021/jm901265h BindingDB Entry DOI: 10.7270/Q20R9QC7
					More data for this Ligand-Target Pair
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM50308257 (1-O-Methyl-2,3-O-isopropylidene-5-(4-carboxylate e...) Show SMILES CCOC(=O)c1cn(C[C@H]2O[C@@H](OC)[C@@H]3OC(C)(C)O[C@H]23)nn1 |r| Show InChI InChI=1S/C14H21N3O6/c1-5-20-12(18)8-6-17(16-15-8)7-9-10-11(13(19-4)21-9)23-14(2,3)22-10/h6,9-11,13H,5,7H2,1-4H3/t9-,10-,11-,13-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase MAL12 assessed as inhibition of p-nitrophenol release by spectrophotometry				J Med Chem 53: 2364-75 (2010) Article DOI: 10.1021/jm901265h BindingDB Entry DOI: 10.7270/Q20R9QC7
					More data for this Ligand-Target Pair
Thioredoxin glutathione reductase (Schistosoma mansoni)	BDBM50532917 (CHEMBL1455957) Show SMILES CCc1nc2c([nH]1)c1no[n+]([O-])c1c1no[n+]([O-])c21 Show InChI InChI=1S/C9H6N6O4/c1-2-3-10-4-5(11-3)8-7(13-19-14(8)16)9-6(4)12-18-15(9)17/h2H2,1H3,(H,10,11)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni TGR				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Thioredoxin glutathione reductase (Schistosoma mansoni)	BDBM50532917 (CHEMBL1455957) Show SMILES CCc1nc2c([nH]1)c1no[n+]([O-])c1c1no[n+]([O-])c21 Show InChI InChI=1S/C9H6N6O4/c1-2-3-10-4-5(11-3)8-7(13-19-14(8)16)9-6(4)12-18-15(9)17/h2H2,1H3,(H,10,11)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni TGR				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM50308260 (1-O-Methyl-2,3-O-isopropylidene-5-[4-(tetrahydro-2...) Show SMILES CO[C@@H]1O[C@H](Cn2cc(COC3CCCCO3)nn2)[C@H]2OC(C)(C)O[C@@H]12 |r| Show InChI InChI=1S/C17H27N3O6/c1-17(2)25-14-12(24-16(21-3)15(14)26-17)9-20-8-11(18-19-20)10-23-13-6-4-5-7-22-13/h8,12-16H,4-7,9-10H2,1-3H3/t12-,13?,14-,15-,16-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase MAL12 assessed as inhibition of p-nitrophenol release by spectrophotometry				J Med Chem 53: 2364-75 (2010) Article DOI: 10.1021/jm901265h BindingDB Entry DOI: 10.7270/Q20R9QC7
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532919 (CHEMBL4534899) Show SMILES Ic1ccc(cc1)N1C(=O)CC(Sc2nnc[nH]2)C1=O Show InChI InChI=1S/C12H9IN4O2S/c13-7-1-3-8(4-2-7)17-10(18)5-9(11(17)19)20-12-14-6-15-16-12/h1-4,6,9H,5H2,(H,14,15,16)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532920 (CHEMBL4522839) Show SMILES O=S(=O)(Cc1ccccc1)c1nc2ccccc2s1 Show InChI InChI=1S/C14H11NO2S2/c16-19(17,10-11-6-2-1-3-7-11)14-15-12-8-4-5-9-13(12)18-14/h1-9H,10H2	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532916 (CHEMBL1380406) Show SMILES Cc1noc(\C=C\c2ccccn2)c1[N+]([O-])=O Show InChI InChI=1S/C11H9N3O3/c1-8-11(14(15)16)10(17-13-8)6-5-9-4-2-3-7-12-9/h2-7H,1H3/b6-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532921 (CHEMBL594404) Show SMILES COc1ccc(\C=C\[N+]([O-])=O)cc1OC Show InChI InChI=1S/C10H11NO4/c1-14-9-4-3-8(5-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3/b6-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532921 (CHEMBL594404) Show SMILES COc1ccc(\C=C\[N+]([O-])=O)cc1OC Show InChI InChI=1S/C10H11NO4/c1-14-9-4-3-8(5-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3/b6-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532920 (CHEMBL4522839) Show SMILES O=S(=O)(Cc1ccccc1)c1nc2ccccc2s1 Show InChI InChI=1S/C14H11NO2S2/c16-19(17,10-11-6-2-1-3-7-11)14-15-12-8-4-5-9-13(12)18-14/h1-9H,10H2	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532919 (CHEMBL4534899) Show SMILES Ic1ccc(cc1)N1C(=O)CC(Sc2nnc[nH]2)C1=O Show InChI InChI=1S/C12H9IN4O2S/c13-7-1-3-8(4-2-7)17-10(18)5-9(11(17)19)20-12-14-6-15-16-12/h1-4,6,9H,5H2,(H,14,15,16)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50532916 (CHEMBL1380406) Show SMILES Cc1noc(\C=C\c2ccccn2)c1[N+]([O-])=O Show InChI InChI=1S/C11H9N3O3/c1-8-11(14(15)16)10(17-13-8)6-5-9-4-2-3-7-12-9/h2-7H,1H3/b6-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Goi£s Curated by ChEMBL					Assay Description Inhibition of papaya papain using Z-FR-AMC fluorogenic peptide substrate preincubated for 5 mins followed by substrate addition				J Med Chem 59: 7075-88 (2016) Article DOI: 10.1021/acs.jmedchem.5b02038 BindingDB Entry DOI: 10.7270/Q2M3308Z
					More data for this Ligand-Target Pair
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM50333465 ((2R,3R,4R,5R,6R)-5-((2R,3R,4R,5S,6R)-5-((2R,3R,4S,...) Show SMILES C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O |r,t:37| Show InChI InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.09E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of yeast alpha-glucosidase MAL12 assessed as inhibition of p-nitrophenol release by spectrophotometry				J Med Chem 53: 2364-75 (2010) Article DOI: 10.1021/jm901265h BindingDB Entry DOI: 10.7270/Q20R9QC7
					More data for this Ligand-Target Pair