Found 89 hits in this display 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 |
Siderophore-binding protein
(Mycobacterium tuberculosis) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | UniProtKB/TrEMBL
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| 570 | -35.6 | n/a | n/a | n/a | n/a | n/a | 7.5 | 25 |
Università degli Studi di Firenze
| Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ... |
J Enzyme Inhib Med Chem 28: 392-6 (2013)
Article DOI: 10.3109/14756366.2011.650168 BindingDB Entry DOI: 10.7270/Q2RF5SZW |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Mycobacterium tuberculosis) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
UniProtKB/SwissProt
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| 590 | -35.6 | n/a | n/a | n/a | n/a | n/a | 7.5 | 25 |
Università degli Studi di Firenze
| Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ... |
J Enzyme Inhib Med Chem 28: 392-6 (2013)
Article DOI: 10.3109/14756366.2011.650168 BindingDB Entry DOI: 10.7270/Q2RF5SZW |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
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| 1.61E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA2 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
NCI pathway Reactome pathway KEGG
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| 2.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA1 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Beta-carbonic anhydrase 1
(Mycobacterium tuberculosis) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
KEGG
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| 5.92E+3 | -29.8 | n/a | n/a | n/a | n/a | n/a | 7.5 | 25 |
Università degli Studi di Firenze
| Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ... |
J Enzyme Inhib Med Chem 28: 392-6 (2013)
Article DOI: 10.3109/14756366.2011.650168 BindingDB Entry DOI: 10.7270/Q2RF5SZW |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| 6.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA7 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 5A, mitochondrial
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | Reactome pathway KEGG
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| 6.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA5A by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 6
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
UniProtKB/SwissProt
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| Article PubMed
| 7.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA6 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| Article PubMed
| 7.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA9 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 14
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
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| Article PubMed
| 8.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA14 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 14
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
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| Article PubMed
| 8.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 14 preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 23: 7181-8 (2015)
Article DOI: 10.1016/j.bmc.2015.10.014 BindingDB Entry DOI: 10.7270/Q29W0HB2 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| Article PubMed
| 9.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human catalytic domain of carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 23: 7181-8 (2015)
Article DOI: 10.1016/j.bmc.2015.10.014 BindingDB Entry DOI: 10.7270/Q29W0HB2 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| Article PubMed
| 9.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA12 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 5B, mitochondrial
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | Reactome pathway KEGG
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| Article PubMed
| 9.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA5B by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 3
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| Article PubMed
| 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA3 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| 1.01E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of human CA4 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
KEGG
UniProtKB/SwissProt
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| Article PubMed
| 1.08E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Hacettepe University
Curated by ChEMBL
| Assay Description Inhibition of HDAC in human Hela cells nuclear extracts by fluorimetric assay |
Bioorg Med Chem 17: 5219-28 (2009)
Article DOI: 10.1016/j.bmc.2009.05.042 BindingDB Entry DOI: 10.7270/Q22F7R82 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 13
(Mus musculus (mouse)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| 1.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of mouse CA13 by stopped-flow CO2 hydration assay |
Bioorg Med Chem 18: 2159-64 (2010)
Article DOI: 10.1016/j.bmc.2010.01.076 BindingDB Entry DOI: 10.7270/Q2GQ6ZP1 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 13
(Mus musculus (mouse)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| 1.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description Inhibition of mouse carbonic anhydrase 13 preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 23: 7181-8 (2015)
Article DOI: 10.1016/j.bmc.2015.10.014 BindingDB Entry DOI: 10.7270/Q29W0HB2 |
More data for this Ligand-Target Pair | |
Prolyl 4-hydroxylase subunit alpha-1
(Gallus gallus (Chicken)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
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| 1.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oulu
| Assay Description Inhibition assay using procollagen-prolin, 2-oxoglutarate 4-dioxygenase. |
J Biol Chem 261: 7819-23 (1986)
BindingDB Entry DOI: 10.7270/Q2SJ1J6Z |
More data for this Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| 4.00E+5 | n/a | 1.20E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Hebrew University of Jerusalem
| Assay Description The activity of EGFR, preactivated with EGF, is measured by its ability to transfer terminal phosphate from [gamma-32P]ATP to poly(GAT) substrate. |
J Med Chem 32: 2344-52 (1989)
Article DOI: 10.1021/jm00130a020 BindingDB Entry DOI: 10.7270/Q2G44NHF |
More data for this Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University of Chinese Medicine
Curated by ChEMBL
| Assay Description Inhibition of MMP9 in human Hep3B cells using gelatin as substrate |
Bioorg Med Chem Lett 23: 1206-11 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.027 BindingDB Entry DOI: 10.7270/Q2H996JF |
More data for this Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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| Article PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University of Chinese Medicine
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP9 using succinylated gelatin as substrate incubated for 30 mins prior to substrate addition measured after 60 mins |
Bioorg Med Chem Lett 23: 1206-11 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.027 BindingDB Entry DOI: 10.7270/Q2H996JF |
More data for this Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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UniProtKB/SwissProt
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| Article PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University of Chinese Medicine
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP2 using succinylated gelatin as substrate incubated for 30 mins prior to substrate addition measured after 60 mins |
Bioorg Med Chem Lett 23: 1206-11 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.027 BindingDB Entry DOI: 10.7270/Q2H996JF |
More data for this Ligand-Target Pair | |
Catechol O-methyltransferase
(Rattus norvegicus (Rat)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
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| n/a | n/a | 93 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Porto
Curated by ChEMBL
| Assay Description Inhibition of MB-COMT in Wistar rat brain assessed as metanephrine formation preincubated for 20 mins followed by addition of adrenaline as substrate... |
J Med Chem 59: 7584-97 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00666 BindingDB Entry DOI: 10.7270/Q2HQ43DN |
More data for this Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
Reactome pathway KEGG
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| n/a | n/a | 125 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Displacement of [125-I]-[Sar1, AngII from AT1R (unknown origin) expressed in Escherichia coli BL 21 (DE3) incubated for 2 hrs by radioimmunoassay |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00123 BindingDB Entry DOI: 10.7270/Q2ZP49Z0 |
More data for this Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| n/a | n/a | 239 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University of Chinese Medicine
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP1 using succinylated gelatin as substrate incubated for 30 mins prior to substrate addition measured after 60 mins |
Bioorg Med Chem Lett 23: 1206-11 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.027 BindingDB Entry DOI: 10.7270/Q2H996JF |
More data for this Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
UniProtKB/TrEMBL
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| Article PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
UMR CNRS 8009
Curated by ChEMBL
| Assay Description Inhibition of HIV1 integrase in presence of Mn2+ |
Bioorg Med Chem Lett 18: 4736-40 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.063 BindingDB Entry DOI: 10.7270/Q2Q24311 |
More data for this Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
UniProtKB/TrEMBL
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| Article PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
UMR CNRS 8009
Curated by ChEMBL
| Assay Description Inhibition of HIV1 integrase by overall integration assay |
Bioorg Med Chem Lett 18: 4736-40 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.063 BindingDB Entry DOI: 10.7270/Q2Q24311 |
More data for this Ligand-Target Pair | |
Lysine-specific demethylase 5B
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
UniProtKB/SwissProt
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| | n/a | n/a | 2.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Seed linoleate 13S-lipoxygenase-1
(Glycine max (soybean)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
KEGG
UniProtKB/SwissProt
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| Article PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description In vitro inhibitory activity against 5-lipoxygenase obtained from potato |
Bioorg Med Chem Lett 15: 4842-5 (2005)
Article DOI: 10.1016/j.bmcl.2005.07.036 BindingDB Entry DOI: 10.7270/Q2RJ4K7N |
More data for this Ligand-Target Pair | |
Lipoxygenase
(Solanum tuberosum (potato)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | KEGG
UniProtKB/TrEMBL
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| Article PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
| Assay Description The lipoxygenase inhibitor screening assay detects and measures the hydroperoxides produced in the lipoxygenation reaction using a purified lipoxygen... |
J Med Chem 49: 1668-83 (2006)
Article DOI: 10.1021/jm0510474 BindingDB Entry DOI: 10.7270/Q2DV1H5S |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| n/a | n/a | 3.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description Inhibition of human recombinant PTP1B after 10 mins |
J Nat Prod 72: 1198-201 (2009)
Article DOI: 10.1021/np800643n BindingDB Entry DOI: 10.7270/Q200027K |
More data for this Ligand-Target Pair | |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
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| Article PubMed
| n/a | n/a | 3.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description Inhibition of DPP4 (unknown origin) using Gly-Pro-AMC as substrate preincubated for 4 secs followed by substrate addition and measured after 30 mins ... |
Eur J Med Chem 151: 145-157 (2018)
Article DOI: 10.1016/j.ejmech.2018.03.041 BindingDB Entry DOI: 10.7270/Q2CZ39SV |
More data for this Ligand-Target Pair | |
Lipoxygenase
(Solanum tuberosum (potato)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | KEGG
UniProtKB/TrEMBL
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| Article PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta
Curated by ChEMBL
| Assay Description Inhibition of potato 5-LOX after 5 mins by enzyme immuno assay |
Bioorg Med Chem Lett 19: 6855-61 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.083 BindingDB Entry DOI: 10.7270/Q2D79CB6 |
More data for this Ligand-Target Pair | |
Catechol O-methyltransferase
(Rattus norvegicus (Rat)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
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Patents
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| Article PubMed
| n/a | n/a | 5.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Porto
Curated by ChEMBL
| Assay Description Inhibition of S-COMT in Wistar rat liver assessed as metanephrine formation preincubated for 20 mins followed by addition of adrenaline as substrate ... |
J Med Chem 59: 7584-97 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00666 BindingDB Entry DOI: 10.7270/Q2HQ43DN |
More data for this Ligand-Target Pair | |
Large T antigen
(Simian virus 40) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
KEGG
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| PCBioAssay
| n/a | n/a | 7.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Southern Research Specialized Biocontainment Screening Center
Curated by PubChem BioAssay
| Assay Description A biochemical assay using the ADP-Hunter methodology, purified TAg, and ATP to identify compounds that inhibit the ATPase activity of Tag Southern Re... |
PubChem Bioassay (2010)
BindingDB Entry DOI: 10.7270/Q2M61HQ8 |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
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Patents
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| Article PubMed
| n/a | n/a | 8.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Ferrara
Curated by ChEMBL
| Assay Description Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon... |
Eur J Med Chem 101: 573-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.07.011 BindingDB Entry DOI: 10.7270/Q2V69MDP |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Ferrara
Curated by ChEMBL
| Assay Description Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b... |
Eur J Med Chem 101: 573-83 (2015)
Article DOI: 10.1016/j.ejmech.2015.07.011 BindingDB Entry DOI: 10.7270/Q2V69MDP |
More data for this Ligand-Target Pair | |
Amyloid-beta precursor protein
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
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| Article PubMed
| n/a | n/a | 1.56E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Academia Sinica
Curated by ChEMBL
| Assay Description Inhibition of amyloid beta (1 to 42) fibrillization (unknown origin) incubated with agitation for 1 min every hr measured over 80 hrs by thioflavin-T... |
Eur J Med Chem 158: 393-404 (2018)
Article DOI: 10.1016/j.ejmech.2018.08.084 BindingDB Entry DOI: 10.7270/Q2QJ7M0R |
More data for this Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
KEGG
UniProtKB/SwissProt
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Patents
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| | n/a | n/a | 1.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
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| PubMed
| n/a | n/a | 1.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dainippon Pharmaceutical Co., Ltd.
Curated by ChEMBL
| Assay Description Inhibitory activity against 5-lipoxygenase in guinea pig leukocyte |
J Med Chem 32: 583-93 (1989)
BindingDB Entry DOI: 10.7270/Q2N878R3 |
More data for this Ligand-Target Pair | |
DNA-directed RNA polymerase subunit beta
(Escherichia coli) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
UniProtKB/TrEMBL
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| PCBioAssay
| n/a | n/a | 2.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
PCMD
Curated by PubChem BioAssay
| Assay Description Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw... |
PubChem Bioassay (2008)
BindingDB Entry DOI: 10.7270/Q23N21T1 |
More data for this Ligand-Target Pair | |
Integrase
(Human immunodeficiency virus 1) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
UniProtKB/TrEMBL
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Patents
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| Article PubMed
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
UMR CNRS 8009
Curated by ChEMBL
| Assay Description Inhibition of HIV1 integrase strand transfer activity |
Bioorg Med Chem Lett 18: 4736-40 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.063 BindingDB Entry DOI: 10.7270/Q2Q24311 |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
Similars
| Article PubMed
| n/a | n/a | 2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Université de Moncton
Curated by ChEMBL
| Assay Description Inhibition of human 5LOX expressed in HEK293 cells |
Bioorg Med Chem Lett 19: 1118-21 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.108 BindingDB Entry DOI: 10.7270/Q21R6QCD |
More data for this Ligand-Target Pair | |
BiP isoform A
(Glycine max) | BDBM50332787
(3-(4-Chlorobenzyl)-N-cyclohexyl-1,2,4-oxadiazol-5-...)Show InChI InChI=1S/C15H18ClN3O/c16-12-8-6-11(7-9-12)10-14-18-15(20-19-14)17-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,17,18,19) | KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Democritus University of Thrace
Curated by ChEMBL
| Assay Description Inhibition of soybean lipoxygenase at by UV spectrophotometry |
Eur J Med Chem 45: 5635-45 (2010)
Article DOI: 10.1016/j.ejmech.2010.09.016 BindingDB Entry DOI: 10.7270/Q2VD6ZQS |
More data for this Ligand-Target Pair | |
BiP isoform A
(Glycine max) | BDBM50332789
(CHEMBL1630603 | N1,N1-Dimethyl-N3-(3-p-tolyl-1,2,4...)Show InChI InChI=1S/C14H20N4O/c1-11-5-7-12(8-6-11)13-16-14(19-17-13)15-9-4-10-18(2)3/h5-8H,4,9-10H2,1-3H3,(H,15,16,17) | KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Democritus University of Thrace
Curated by ChEMBL
| Assay Description Inhibition of soybean lipoxygenase at by UV spectrophotometry |
Eur J Med Chem 45: 5635-45 (2010)
Article DOI: 10.1016/j.ejmech.2010.09.016 BindingDB Entry DOI: 10.7270/Q2VD6ZQS |
More data for this Ligand-Target Pair | |
Aldo-keto reductase family 1 member B1
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
UniProtKB/SwissProt
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Patents
Similars
| Article PubMed
| n/a | n/a | 3.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Gifu Pharmaceutical University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant N-terminus His6-tagged AKR1B1 expressed in Escherichia coli BL21 DE3 assessed as pyridine-3-aldehyde reduction by spe... |
Eur J Med Chem 48: 321-9 (2012)
Article DOI: 10.1016/j.ejmech.2011.12.034 BindingDB Entry DOI: 10.7270/Q2TT4RDB |
More data for this Ligand-Target Pair | |
Amyloid-beta precursor protein
(Homo sapiens (Human)) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB MMDB
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 | 3.28E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Tsukuba
Curated by ChEMBL
| Assay Description Inhibition of human amyloid beta (1 to 42) aggregation after 24 hrs by thioflavin-T fluorescence assay |
Bioorg Med Chem 20: 5844-9 (2012)
Article DOI: 10.1016/j.bmc.2012.08.001 BindingDB Entry DOI: 10.7270/Q2M048BH |
More data for this Ligand-Target Pair | |
Lysosomal alpha-glucosidase
(Rattus norvegicus) | BDBM4375
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.47E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Chulalongkorn University
Curated by ChEMBL
| Assay Description Inhibition of rat intestine maltase using maltose as substrate incubated for 10 mins prior to substrate addition measured after 40 mins by glucose ox... |
Eur J Med Chem 66: 296-304 (2013)
Article DOI: 10.1016/j.ejmech.2013.05.047 BindingDB Entry DOI: 10.7270/Q2X63PCD |
More data for this Ligand-Target Pair | |