Compile Data Set for Download or QSAR

Found 806 hits with Last Name = 'song' and Initial = 'w'   

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
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50125136 (2-[2,3']Bipyridinyl-6'-yl-1-(2,3-dihydro-benzofura...) Show SMILES C1Cc2cc(ccc2O1)C1N(CCc2c1[nH]c1ccccc21)c1ccc(cn1)-c1ccccn1 Show InChI InChI=1S/C29H24N4O/c1-2-7-25-22(5-1)23-12-15-33(27-11-9-21(18-31-27)24-6-3-4-14-30-24)29(28(23)32-25)20-8-10-26-19(17-20)13-16-34-26/h1-11,14,17-18,29,32H,12-13,15-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of human corpus cavernosum PDE5				Eur J Med Chem 150: 30-38 (2018) Article DOI: 10.1016/j.ejmech.2018.02.039 BindingDB Entry DOI: 10.7270/Q2222XCS
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50388914 (CHEMBL2063274 | US10357546, p-OH SB-3CT) Show SMILES Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C15H14O4S2/c16-11-1-3-12(4-2-11)19-13-5-7-15(8-6-13)21(17,18)10-14-9-20-14/h1-8,14,16H,9-10H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50118253 (1-Benzo[1,3]dioxol-5-yl-2-[5-(3,4-dimethoxy-phenyl...) Show SMILES COc1ccc(cc1OC)-c1cnc(nc1)N1CC(=O)c2c([nH]c3ccccc23)C1c1ccc2OCOc2c1 Show InChI InChI=1S/C30H24N4O5/c1-36-23-9-7-17(11-25(23)37-2)19-13-31-30(32-14-19)34-15-22(35)27-20-5-3-4-6-21(20)33-28(27)29(34)18-8-10-24-26(12-18)39-16-38-24/h3-14,29,33H,15-16H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of human corpus cavernosum PDE5				Eur J Med Chem 150: 30-38 (2018) Article DOI: 10.1016/j.ejmech.2018.02.039 BindingDB Entry DOI: 10.7270/Q2222XCS
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442356 (CHEMBL2442885 | US10357546, ND-380 | US9951035, ND...) Show SMILES COC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H17NO5S2/c1-22-17(19)18-12-2-4-13(5-3-12)23-14-6-8-16(9-7-14)25(20,21)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Urease subunit beta (Helicobacter pylori (strain ATCC 700392 / 26695) (...)	BDBM50602006 (CHEMBL5209436) Show SMILES ONC(=O)CN(c1cccc(c1)[N+]([O-])=O)S(=O)(=O)c1ccc(Br)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	65	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.bmcl.2022.129043 BindingDB Entry DOI: 10.7270/Q23N27G1
					More data for this Ligand-Target Pair
Sialidase A (Streptococcus pneumoniae)	BDBM50182491 (CHEBI:69015 | Malabaricone C) Show SMILES Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1O Show InChI InChI=1S/C21H26O5/c22-16-13-12-15(14-20(16)26)8-5-3-1-2-4-6-9-17(23)21-18(24)10-7-11-19(21)25/h7,10-14,22,24-26H,1-6,8-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Competitive inhibition of Streptococcus pneumoniae sialidase NanA using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate after 60 mi...				Bioorg Med Chem Lett 27: 3060-3064 (2017) Article DOI: 10.1016/j.bmcl.2017.05.055 BindingDB Entry DOI: 10.7270/Q2G73H5Z
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442364 (CHEMBL2442889) Show SMILES COC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H16O6S2/c1-21-17(18)23-14-4-2-12(3-5-14)22-13-6-8-16(9-7-13)25(19,20)11-15-10-24-15/h2-9,15H,10-11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442356 (CHEMBL2442885 | US10357546, ND-380 | US9951035, ND...) Show SMILES COC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H17NO5S2/c1-22-17(19)18-12-2-4-13(5-3-12)23-14-6-8-16(9-7-14)25(20,21)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442364 (CHEMBL2442889) Show SMILES COC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H16O6S2/c1-21-17(18)23-14-4-2-12(3-5-14)22-13-6-8-16(9-7-13)25(19,20)11-15-10-24-15/h2-9,15H,10-11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442363 (CHEMBL2442890 | US10357546, ND-395) Show SMILES CCOC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H18O6S2/c1-2-22-18(19)24-15-5-3-13(4-6-15)23-14-7-9-17(10-8-14)26(20,21)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442357 (CHEMBL2442881) Show SMILES CNC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H18N2O4S2/c1-18-17(20)19-12-2-4-13(5-3-12)23-14-6-8-16(9-7-14)25(21,22)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H2,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	240	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442355 (CHEMBL2442886 | US10357546, ND-394) Show SMILES CCOC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H19NO5S2/c1-2-23-18(20)19-13-3-5-14(6-4-13)24-15-7-9-17(10-8-15)26(21,22)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3,(H,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	290	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442362 (CHEMBL2442891) Show SMILES CCCOC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H20O6S2/c1-2-11-23-19(20)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(21,22)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	310	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Multidrug resistance-associated protein 1 (Homo sapiens (Human))	BDBM50420244 (CHEMBL1628111) Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(O)(=O)=O)ccc34)[C@@H]1CC[C@@H]2O |r| Show InChI InChI=1S/C18H24O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-17,19H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15-,16+,17+,18+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Queen's University Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of LTC4 uptake in membrane vesicle from MRP1-expressing HeLa cells				J Biol Chem 276: 6404-11 (2001) Article DOI: 10.1074/jbc.m008251200 BindingDB Entry DOI: 10.7270/Q29S1TW9
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442360 (CHEMBL2442893) Show SMILES CNC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H17NO5S2/c1-18-17(19)23-14-4-2-12(3-5-14)22-13-6-8-16(9-7-13)25(20,21)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	390	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50005100 (CHEMBL2442884) Show SMILES CC(C)NC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H22N2O4S2/c1-13(2)20-19(22)21-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(23,24)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3,(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50005103 (CHEMBL2442882) Show SMILES CCNC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H20N2O4S2/c1-2-19-18(21)20-13-3-5-14(6-4-13)24-15-7-9-17(10-8-15)26(22,23)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3,(H2,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Multidrug resistance-associated protein 1 (Homo sapiens (Human))	BDBM50366524 (ESTRONE | ESTROPIPATE | Estrone 3-sulfate | Estron...) Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(O)(=O)=O)ccc34)[C@@H]1CCC2=O Show InChI InChI=1S/C18H22O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15-,16+,18+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Queen's University Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of LTC4 uptake in membrane vesicle from MRP1-expressing HeLa cells				J Biol Chem 276: 6404-11 (2001) Article DOI: 10.1074/jbc.m008251200 BindingDB Entry DOI: 10.7270/Q29S1TW9
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442361 (CHEMBL2442892) Show SMILES CC(C)OC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H20O6S2/c1-13(2)23-19(20)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(21,22)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	480	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442354 (CHEMBL2442887) Show SMILES CCCOC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-2-11-24-19(21)20-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(22,23)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	490	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Sialidase A (Streptococcus pneumoniae)	BDBM50182486 (MALABARICONE B) Show SMILES Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1 Show InChI InChI=1S/C21H26O4/c22-17-14-12-16(13-15-17)8-5-3-1-2-4-6-9-18(23)21-19(24)10-7-11-20(21)25/h7,10-15,22,24-25H,1-6,8-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Competitive inhibition of Streptococcus pneumoniae sialidase NanA using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate after 60 mi...				Bioorg Med Chem Lett 27: 3060-3064 (2017) Article DOI: 10.1016/j.bmcl.2017.05.055 BindingDB Entry DOI: 10.7270/Q2G73H5Z
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442359 (CHEMBL2442878) Show SMILES CCNC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H19NO5S2/c1-2-19-18(20)24-15-5-3-13(4-6-15)23-14-7-9-17(10-8-14)26(21,22)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3,(H,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50005099 (CHEMBL2442883) Show SMILES CCCNC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H22N2O4S2/c1-2-11-20-19(22)21-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(23,24)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3,(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	560	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442353 (CHEMBL2442888) Show SMILES CC(C)OC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-13(2)24-19(21)20-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(22,23)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50005101 (CHEMBL2442880) Show SMILES CC(C)NC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-13(2)20-19(21)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(22,23)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	690	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50442358 (CHEMBL2442879) Show SMILES CCCNC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-2-11-20-19(21)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(22,23)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	760	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-2 using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442355 (CHEMBL2442886 | US10357546, ND-394) Show SMILES CCOC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H19NO5S2/c1-2-23-18(20)19-13-3-5-14(6-4-13)24-15-7-9-17(10-8-15)26(21,22)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3,(H,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442363 (CHEMBL2442890 | US10357546, ND-395) Show SMILES CCOC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H18O6S2/c1-2-22-18(19)24-15-5-3-13(4-6-15)23-14-7-9-17(10-8-14)26(20,21)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	930	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442362 (CHEMBL2442891) Show SMILES CCCOC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H20O6S2/c1-2-11-23-19(20)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(21,22)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3	PDB MMDB 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
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442354 (CHEMBL2442887) Show SMILES CCCOC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-2-11-24-19(21)20-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(22,23)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Urease subunit beta (Helicobacter pylori (strain ATCC 700392 / 26695) (...)	BDBM50602006 (CHEMBL5209436) Show SMILES ONC(=O)CN(c1cccc(c1)[N+]([O-])=O)S(=O)(=O)c1ccc(Br)cc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.bmcl.2022.129043 BindingDB Entry DOI: 10.7270/Q23N27G1
					More data for this Ligand-Target Pair
Sialidase A (Streptococcus pneumoniae)	BDBM50303147 ((-)-licarin B | CHEMBL578403) Show SMILES COc1cc(\C=C\C)cc2[C@H](C)[C@H](Oc12)c1ccc2OCOc2c1 |r| Show InChI InChI=1S/C20H20O4/c1-4-5-13-8-15-12(2)19(24-20(15)18(9-13)21-3)14-6-7-16-17(10-14)23-11-22-16/h4-10,12,19H,11H2,1-3H3/b5-4+/t12-,19-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Noncompetitive inhibition of Streptococcus pneumoniae sialidase NanA using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate after 60...				Bioorg Med Chem Lett 27: 3060-3064 (2017) Article DOI: 10.1016/j.bmcl.2017.05.055 BindingDB Entry DOI: 10.7270/Q2G73H5Z
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442361 (CHEMBL2442892) Show SMILES CC(C)OC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H20O6S2/c1-13(2)23-19(20)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(21,22)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442355 (CHEMBL2442886 | US10357546, ND-394) Show SMILES CCOC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H19NO5S2/c1-2-23-18(20)19-13-3-5-14(6-4-13)24-15-7-9-17(10-8-15)26(21,22)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3,(H,19,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442354 (CHEMBL2442887) Show SMILES CCCOC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-2-11-24-19(21)20-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(22,23)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442364 (CHEMBL2442889) Show SMILES COC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H16O6S2/c1-21-17(18)23-14-4-2-12(3-5-14)22-13-6-8-16(9-7-13)25(19,20)11-15-10-24-15/h2-9,15H,10-11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442353 (CHEMBL2442888) Show SMILES CC(C)OC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-13(2)24-19(21)20-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(22,23)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442356 (CHEMBL2442885 | US10357546, ND-380 | US9951035, ND...) Show SMILES COC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H17NO5S2/c1-22-17(19)18-12-2-4-13(5-3-12)23-14-6-8-16(9-7-14)25(20,21)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442363 (CHEMBL2442890 | US10357546, ND-395) Show SMILES CCOC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H18O6S2/c1-2-22-18(19)24-15-5-3-13(4-6-15)23-14-7-9-17(10-8-14)26(20,21)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442353 (CHEMBL2442888) Show SMILES CC(C)OC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H21NO5S2/c1-13(2)24-19(21)20-14-3-5-15(6-4-14)25-16-7-9-18(10-8-16)27(22,23)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442362 (CHEMBL2442891) Show SMILES CCCOC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H20O6S2/c1-2-11-23-19(20)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(21,22)13-17-12-26-17/h3-10,17H,2,11-13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Sialidase A (Streptococcus pneumoniae)	BDBM50242962 (CHEMBL4079519) Show SMILES COc1cc(ccc1O)[C@@H](O)[C@@H](C)Oc1c(OC)cc(\C=C\CO)cc1OC |r| Show InChI InChI=1S/C21H26O7/c1-13(20(24)15-7-8-16(23)17(12-15)25-2)28-21-18(26-3)10-14(6-5-9-22)11-19(21)27-4/h5-8,10-13,20,22-24H,9H2,1-4H3/b6-5+/t13-,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Noncompetitive inhibition of Streptococcus pneumoniae sialidase NanA using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate after 60...				Bioorg Med Chem Lett 27: 3060-3064 (2017) Article DOI: 10.1016/j.bmcl.2017.05.055 BindingDB Entry DOI: 10.7270/Q2G73H5Z
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50442361 (CHEMBL2442892) Show SMILES CC(C)OC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C19H20O6S2/c1-13(2)23-19(20)25-16-5-3-14(4-6-16)24-15-7-9-18(10-8-15)27(21,22)12-17-11-26-17/h3-10,13,17H,11-12H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-14 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Sialidase A (Streptococcus pneumoniae)	BDBM50242963 (CHEBI:86562 | Methoxyeugenol) Show SMILES COc1cc(CC=C)cc(OC)c1O Show InChI InChI=1S/C11H14O3/c1-4-5-8-6-9(13-2)11(12)10(7-8)14-3/h4,6-7,12H,1,5H2,2-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Noncompetitive inhibition of Streptococcus pneumoniae sialidase NanA using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate after 60...				Bioorg Med Chem Lett 27: 3060-3064 (2017) Article DOI: 10.1016/j.bmcl.2017.05.055 BindingDB Entry DOI: 10.7270/Q2G73H5Z
					More data for this Ligand-Target Pair
Sialidase A (Streptococcus pneumoniae)	BDBM50242964 (CHEMBL4072450) Show SMILES COc1c(O)cc(CC=C)cc1O Show InChI InChI=1S/C10H12O3/c1-3-4-7-5-8(11)10(13-2)9(12)6-7/h3,5-6,11-12H,1,4H2,2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Noncompetitive inhibition of Streptococcus pneumoniae sialidase NanA using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate after 60...				Bioorg Med Chem Lett 27: 3060-3064 (2017) Article DOI: 10.1016/j.bmcl.2017.05.055 BindingDB Entry DOI: 10.7270/Q2G73H5Z
					More data for this Ligand-Target Pair
Sialidase A (Streptococcus pneumoniae)	BDBM50303149 ((-)-licarin A | CHEMBL463526 | Licarin A) Show SMILES COc1cc(\C=C\C)cc2[C@H](C)[C@H](Oc12)c1ccc(O)c(OC)c1 |r| Show InChI InChI=1S/C20H22O4/c1-5-6-13-9-15-12(2)19(24-20(15)18(10-13)23-4)14-7-8-16(21)17(11-14)22-3/h5-12,19,21H,1-4H3/b6-5+/t12-,19-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	9.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Noncompetitive inhibition of Streptococcus pneumoniae sialidase NanA using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate after 60...				Bioorg Med Chem Lett 27: 3060-3064 (2017) Article DOI: 10.1016/j.bmcl.2017.05.055 BindingDB Entry DOI: 10.7270/Q2G73H5Z
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442357 (CHEMBL2442881) Show SMILES CNC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H18N2O4S2/c1-18-17(20)19-12-2-4-13(5-3-12)23-14-6-8-16(9-7-14)25(21,22)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H2,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442360 (CHEMBL2442893) Show SMILES CNC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C17H17NO5S2/c1-18-17(19)23-14-4-2-12(3-5-14)22-13-6-8-16(9-7-13)25(20,21)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Neutrophil collagenase (Homo sapiens (Human))	BDBM50442363 (CHEMBL2442890 | US10357546, ND-395) Show SMILES CCOC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H18O6S2/c1-2-22-18(19)24-15-5-3-13(4-6-15)23-14-7-9-17(10-8-14)26(20,21)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-8 catalytic domain using McaKPLGL9(Dpa)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50442359 (CHEMBL2442878) Show SMILES CCNC(=O)Oc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1 Show InChI InChI=1S/C18H19NO5S2/c1-2-19-18(20)24-15-5-3-13(4-6-15)23-14-7-9-17(10-8-14)26(21,22)12-16-11-25-16/h3-10,16H,2,11-12H2,1H3,(H,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Notre Dame Curated by ChEMBL					Assay Description Inhibition of human recombinant MMP-9 catalytic domain using MOCAcPLGLA2pr(Dnp)AR-NH2 as substrate by fluorescence spectrophotometric analysis				J Med Chem 56: 8139-50 (2013) Article DOI: 10.1021/jm401217d BindingDB Entry DOI: 10.7270/Q2BG2QDC
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 806 total )  |  Next  |  Last  >>

Jump to: