Found 137 hits with Last Name = 'hussain' and Initial = 'f' 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 |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 54 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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| PDB Article PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Cytochrome c oxidase subunit 2
(Homo sapiens (Human)) | BDBM17638
![PNG](/data/jpeg/tenK1/BindingDB_17638.png) (2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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| Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human COX2 expressed in baculovirus infected Sf21 cells using arachidonic acid as substrate preincubated for 5 mins followe... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193713
![PNG](/data/jpeg/tenK19/BindingDB_193713.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3n)Show SMILES Cc1ccc(cc1C)-n1cc(CSc2nc(cc(=O)n2C)-c2ccccc2)nn1 Show InChI InChI=1S/C22H21N5OS/c1-15-9-10-19(11-16(15)2)27-13-18(24-25-27)14-29-22-23-20(12-21(28)26(22)3)17-7-5-4-6-8-17/h4-13H,14H2,1-3H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 82 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193706
![PNG](/data/jpeg/tenK19/BindingDB_193706.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3g)Show SMILES CCc1ccc(cc1)-n1cc(CSc2nc(cc(=O)n2C)-c2ccccc2)nn1 Show InChI InChI=1S/C22H21N5OS/c1-3-16-9-11-19(12-10-16)27-14-18(24-25-27)15-29-22-23-20(13-21(28)26(22)2)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 94 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193709
![PNG](/data/jpeg/tenK19/BindingDB_193709.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3j)Show SMILES Cn1c(SCc2cn(nn2)-c2ccccc2F)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16FN5OS/c1-25-19(27)11-17(14-7-3-2-4-8-14)22-20(25)28-13-15-12-26(24-23-15)18-10-6-5-9-16(18)21/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 122 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193717
![PNG](/data/jpeg/tenK19/BindingDB_193717.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3r)Show SMILES Cn1c(SCc2cn(nn2)-c2cccc(c2)[N+]([O-])=O)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C21H18N6O3S/c1-14-8-9-17(27(29)30)10-19(14)26-12-16(23-24-26)13-31-21-22-18(11-20(28)25(21)2)15-6-4-3-5-7-15/h3-12H,13H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 153 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM189387
![PNG](/data/jpeg/tenK18/BindingDB_189387.png) (3-((1-(2-chlorophenyl)-1H-1,2,3-triazol-4-yl)methy...)Show InChI InChI=1S/C15H10ClN5O2/c16-11-4-1-2-5-12(11)21-9-10(18-19-21)8-20-14-13(23-15(20)22)6-3-7-17-14/h1-7,9H,8H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193701
![PNG](/data/jpeg/tenK19/BindingDB_193701.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3b)Show SMILES Cn1c(SCc2cn(nn2)-c2ccc(F)cc2)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16FN5OS/c1-25-19(27)11-18(14-5-3-2-4-6-14)22-20(25)28-13-16-12-26(24-23-16)17-9-7-15(21)8-10-17/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM189384
![PNG](/data/jpeg/tenK18/BindingDB_189384.png) (3-((1-(pyridin-3-yl)-1H-1,2,3-triazol-4-yl)methyl)...)Show InChI InChI=1S/C14H10N6O2/c21-14-19(13-12(22-14)4-2-6-16-13)8-10-9-20(18-17-10)11-3-1-5-15-7-11/h1-7,9H,8H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM17638
![PNG](/data/jpeg/tenK1/BindingDB_17638.png) (2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of sheep COX1 using arachidonic acid as substrate preincubated for 5 mins followed by substrate addition and measured after 5 mins by UV-v... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM11639
![PNG](/data/jpeg/tenK1/BindingDB_11639.png) (4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank PDB Article PubMed
| n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Cytochrome c oxidase subunit 2
(Homo sapiens (Human)) | BDBM11639
![PNG](/data/jpeg/tenK1/BindingDB_11639.png) (4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human COX2 expressed in baculovirus infected Sf21 cells using arachidonic acid as substrate preincubated for 5 mins followe... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193703
![PNG](/data/jpeg/tenK19/BindingDB_193703.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3d)Show SMILES Cc1ccccc1-n1cc(CSc2nc(cc(=O)n2C)-c2ccccc2)nn1 Show InChI InChI=1S/C21H19N5OS/c1-15-8-6-7-11-19(15)26-13-17(23-24-26)14-28-21-22-18(12-20(27)25(21)2)16-9-4-3-5-10-16/h3-13H,14H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 302 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM189386
![PNG](/data/jpeg/tenK18/BindingDB_189386.png) (3-((1-(2-bromophenyl)-1H-1,2,3-triazol-4-yl)methyl...)Show InChI InChI=1S/C15H10BrN5O2/c16-11-4-1-2-5-12(11)21-9-10(18-19-21)8-20-14-13(23-15(20)22)6-3-7-17-14/h1-7,9H,8H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 310 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM189389
![PNG](/data/jpeg/tenK18/BindingDB_189389.png) (3-((1-(2-fluorophenyl)-1H-1,2,3-triazol-4-yl)methy...)Show InChI InChI=1S/C15H10FN5O2/c16-11-4-1-2-5-12(11)21-9-10(18-19-21)8-20-14-13(23-15(20)22)6-3-7-17-14/h1-7,9H,8H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193702
![PNG](/data/jpeg/tenK19/BindingDB_193702.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3c)Show SMILES Cn1c(SCc2cn(nn2)-c2ccccc2Br)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16BrN5OS/c1-25-19(27)11-17(14-7-3-2-4-8-14)22-20(25)28-13-15-12-26(24-23-15)18-10-6-5-9-16(18)21/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 437 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 1
(Ovis aries (Sheep)) | BDBM13066
![PNG](/data/jpeg/tenK1/BindingDB_13066.png) (2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid...)Show InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 480 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of sheep COX1 using arachidonic acid as substrate preincubated for 5 mins followed by substrate addition and measured after 5 mins by UV-v... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193710
![PNG](/data/jpeg/tenK19/BindingDB_193710.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3k)Show SMILES Cn1c(SCc2cn(nn2)-c2cccc(Cl)c2)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16ClN5OS/c1-25-19(27)11-18(14-6-3-2-4-7-14)22-20(25)28-13-16-12-26(24-23-16)17-9-5-8-15(21)10-17/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 502 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193712
![PNG](/data/jpeg/tenK19/BindingDB_193712.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3m)Show SMILES Cn1c(SCc2cn(nn2)-c2ccccc2Cl)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16ClN5OS/c1-25-19(27)11-17(14-7-3-2-4-8-14)22-20(25)28-13-15-12-26(24-23-15)18-10-6-5-9-16(18)21/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 577 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193716
![PNG](/data/jpeg/tenK19/BindingDB_193716.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3q)Show SMILES Cn1c(SCc2cn(nn2)-c2ccc(cc2)[N+]([O-])=O)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16N6O3S/c1-24-19(27)11-18(14-5-3-2-4-6-14)21-20(24)30-13-15-12-25(23-22-15)16-7-9-17(10-8-16)26(28)29/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 587 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM50000541
![PNG](/data/jpeg/tenK5000/BindingDB_50000541.png) ((+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea |...)Show InChI InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL DrugBank MCE PC cid PC sid UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 630 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human 5LOX expressed in baculovirus infected Sf insect cells using linoleic acid as substrate preincubated for 5 mins follo... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM189394
![PNG](/data/jpeg/tenK18/BindingDB_189394.png) (3-((1-o-tolyl-1H-1,2,3-triazol-4-yl)methyl)oxazolo...)Show InChI InChI=1S/C16H13N5O2/c1-11-5-2-3-6-13(11)21-10-12(18-19-21)9-20-15-14(23-16(20)22)7-4-8-17-15/h2-8,10H,9H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 650 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM189397
![PNG](/data/jpeg/tenK18/BindingDB_189397.png) (3-((1-(2-methoxyphenyl)-1H-1,2,3-triazol-4-yl)meth...)Show InChI InChI=1S/C16H13N5O3/c1-23-13-6-3-2-5-12(13)21-10-11(18-19-21)9-20-15-14(24-16(20)22)7-4-8-17-15/h2-8,10H,9H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193700
![PNG](/data/jpeg/tenK19/BindingDB_193700.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3a)Show SMILES Cn1c(SCc2cn(nn2)-c2ccc(Br)cc2)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16BrN5OS/c1-25-19(27)11-18(14-5-3-2-4-6-14)22-20(25)28-13-16-12-26(24-23-16)17-9-7-15(21)8-10-17/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 744 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM50558938
![PNG](/data/jpeg/tenK5055/BindingDB_50558938.png) (CHEMBL4797337)Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)CC(CC(=O)c2ccccn2)C1=O | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 810 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human 5LOX expressed in baculovirus infected Sf insect cells using linoleic acid as substrate preincubated for 5 mins follo... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human)) | BDBM50558934
![PNG](/data/jpeg/tenK5055/BindingDB_50558934.png) (CHEMBL4754218)Show SMILES Cc1ccc(cc1)C(=O)CC1CC(=O)N(C1=O)c1ccc(cc1)S(N)(=O)=O | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
MCE PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 860 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human 5LOX expressed in baculovirus infected Sf insect cells using linoleic acid as substrate preincubated for 5 mins follo... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193704
![PNG](/data/jpeg/tenK19/BindingDB_193704.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3e)Show SMILES Cn1c(SCc2cn(nn2)-c2ccccc2)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H17N5OS/c1-24-19(26)12-18(15-8-4-2-5-9-15)21-20(24)27-14-16-13-25(23-22-16)17-10-6-3-7-11-17/h2-13H,14H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 916 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Cytochrome c oxidase subunit 2
(Homo sapiens (Human)) | BDBM50558934
![PNG](/data/jpeg/tenK5055/BindingDB_50558934.png) (CHEMBL4754218)Show SMILES Cc1ccc(cc1)C(=O)CC1CC(=O)N(C1=O)c1ccc(cc1)S(N)(=O)=O | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
MCE PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 980 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human COX2 expressed in baculovirus infected Sf21 cells using arachidonic acid as substrate preincubated for 5 mins followe... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193714
![PNG](/data/jpeg/tenK19/BindingDB_193714.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3o)Show SMILES COc1ccc(cc1)-n1cc(CSc2nc(cc(=O)n2C)-c2ccccc2)nn1 Show InChI InChI=1S/C21H19N5O2S/c1-25-20(27)12-19(15-6-4-3-5-7-15)22-21(25)29-14-16-13-26(24-23-16)17-8-10-18(28-2)11-9-17/h3-13H,14H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.14E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193708
![PNG](/data/jpeg/tenK19/BindingDB_193708.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3i)Show SMILES COc1ccccc1-n1cc(CSc2nc(cc(=O)n2C)-c2ccccc2)nn1 Show InChI InChI=1S/C21H19N5O2S/c1-25-20(27)12-17(15-8-4-3-5-9-15)22-21(25)29-14-16-13-26(24-23-16)18-10-6-7-11-19(18)28-2/h3-13H,14H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193705
![PNG](/data/jpeg/tenK19/BindingDB_193705.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3f)Show SMILES Cn1c(SCc2cn(nn2)-c2ccc(cc2)C(C)(C)C)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C24H25N5OS/c1-24(2,3)18-10-12-20(13-11-18)29-15-19(26-27-29)16-31-23-25-21(14-22(30)28(23)4)17-8-6-5-7-9-17/h5-15H,16H2,1-4H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193707
![PNG](/data/jpeg/tenK19/BindingDB_193707.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3h)Show SMILES CCOc1ccc(cc1)-n1cc(CSc2nc(cc(=O)n2C)-c2ccccc2)nn1 Show InChI InChI=1S/C22H21N5O2S/c1-3-29-19-11-9-18(10-12-19)27-14-17(24-25-27)15-30-22-23-20(13-21(28)26(22)2)16-7-5-4-6-8-16/h4-14H,3,15H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193715
![PNG](/data/jpeg/tenK19/BindingDB_193715.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3p)Show SMILES Cn1c(SCc2cn(nn2)-c2ccc(Cl)cc2)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C20H16ClN5OS/c1-25-19(27)11-18(14-5-3-2-4-6-14)22-20(25)28-13-16-12-26(24-23-16)17-9-7-15(21)8-10-17/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM193711
![PNG](/data/jpeg/tenK19/BindingDB_193711.png) (Pyrimidin-4-one-1,2,3-triazole conjugate, 3l)Show SMILES Cn1c(SCc2cn(nn2)-c2cccnc2)nc(cc1=O)-c1ccccc1 Show InChI InChI=1S/C19H16N6OS/c1-24-18(26)10-17(14-6-3-2-4-7-14)21-19(24)27-13-15-12-25(23-22-15)16-8-5-9-20-11-16/h2-12H,13H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.74E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolved in dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 ... |
Bioorg Chem 68: 41-55 (2016)
Article DOI: 10.1016/j.bioorg.2016.07.007 BindingDB Entry DOI: 10.7270/Q2WM1C6H |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016433
![PNG](/data/jpeg/tenK5001/BindingDB_50016433.png) (CHEMBL3264693)Show InChI InChI=1S/C16H11ClN4OS/c17-11-5-7-13(8-6-11)21-9-12(19-20-21)10-23-16-18-14-3-1-2-4-15(14)22-16/h1-9H,10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Cytochrome c oxidase subunit 2
(Homo sapiens (Human)) | BDBM50558936
![PNG](/data/jpeg/tenK5055/BindingDB_50558936.png) (CHEMBL4794507)Show SMILES COc1ccc(cc1)C(=O)CC1CC(=O)N(C1=O)c1ccc(cc1)S(N)(=O)=O | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human COX2 expressed in baculovirus infected Sf21 cells using arachidonic acid as substrate preincubated for 5 mins followe... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016431
![PNG](/data/jpeg/tenK5001/BindingDB_50016431.png) (CHEMBL3264691)Show InChI InChI=1S/C17H14N4O2S/c1-22-14-8-6-13(7-9-14)21-10-12(19-20-21)11-24-17-18-15-4-2-3-5-16(15)23-17/h2-10H,11H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016401
![PNG](/data/jpeg/tenK5001/BindingDB_50016401.png) (CHEMBL3264699)Show InChI InChI=1S/C16H11FN4OS/c17-12-5-1-3-7-14(12)21-9-11(19-20-21)10-23-16-18-13-6-2-4-8-15(13)22-16/h1-9H,10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM189385
![PNG](/data/jpeg/tenK18/BindingDB_189385.png) (3-((1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl)methy...)Show InChI InChI=1S/C15H10FN5O2/c16-10-3-5-12(6-4-10)21-9-11(18-19-21)8-20-14-13(23-15(20)22)2-1-7-17-14/h1-7,9H,8H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.49E+3 | n/a | n/a | n/a | n/a | n/a | 30 |
Hamdard University (Jamia Hamdard)
| Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ... |
Chem Biol Drug Des 87: 918-26 (2016)
Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016438
![PNG](/data/jpeg/tenK5001/BindingDB_50016438.png) (CHEMBL3264698)Show InChI InChI=1S/C16H11BrN4OS/c17-12-5-1-3-7-14(12)21-9-11(19-20-21)10-23-16-18-13-6-2-4-8-15(13)22-16/h1-9H,10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.75E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016435
![PNG](/data/jpeg/tenK5001/BindingDB_50016435.png) (CHEMBL3264695)Show InChI InChI=1S/C16H11BrN4OS/c17-11-5-7-13(8-6-11)21-9-12(19-20-21)10-23-16-18-14-3-1-2-4-15(14)22-16/h1-9H,10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016428
![PNG](/data/jpeg/tenK5001/BindingDB_50016428.png) (CHEMBL3264702)Show InChI InChI=1S/C18H16N4O2S/c1-2-23-15-9-7-14(8-10-15)22-11-13(20-21-22)12-25-18-19-16-5-3-4-6-17(16)24-18/h3-11H,2,12H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016434
![PNG](/data/jpeg/tenK5001/BindingDB_50016434.png) (CHEMBL3264694)Show InChI InChI=1S/C16H11ClN4OS/c17-12-5-1-3-7-14(12)21-9-11(19-20-21)10-23-16-18-13-6-2-4-8-15(13)22-16/h1-9H,10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016442
![PNG](/data/jpeg/tenK5001/BindingDB_50016442.png) (CHEMBL3264690)Show InChI InChI=1S/C18H16N4OS/c1-2-13-7-9-15(10-8-13)22-11-14(20-21-22)12-24-18-19-16-5-3-4-6-17(16)23-18/h3-11H,2,12H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| 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 |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016427
![PNG](/data/jpeg/tenK5001/BindingDB_50016427.png) (CHEMBL3264701)Show SMILES CC(C)(C)c1ccc(cc1)-n1cc(CSc2nc3ccccc3o2)nn1 Show InChI InChI=1S/C20H20N4OS/c1-20(2,3)14-8-10-16(11-9-14)24-12-15(22-23-24)13-26-19-21-17-6-4-5-7-18(17)25-19/h4-12H,13H2,1-3H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016429
![PNG](/data/jpeg/tenK5001/BindingDB_50016429.png) (CHEMBL3264703)Show InChI InChI=1S/C15H11N5OS/c1-2-6-14-13(5-1)17-15(21-14)22-10-11-9-20(19-18-11)12-4-3-7-16-8-12/h1-9H,10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Cytochrome c oxidase subunit 2
(Homo sapiens (Human)) | BDBM50558937
![PNG](/data/jpeg/tenK5055/BindingDB_50558937.png) (CHEMBL4779865)Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)CC(CC(=O)c2ccccc2)C1=O | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 4.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of recombinant human COX2 expressed in baculovirus infected Sf21 cells using arachidonic acid as substrate preincubated for 5 mins followe... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2019.111863 BindingDB Entry DOI: 10.7270/Q27S7SFQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016419
![PNG](/data/jpeg/tenK5001/BindingDB_50016419.png) (CHEMBL3264700)Show InChI InChI=1S/C18H16N4OS/c1-12-7-8-15(9-13(12)2)22-10-14(20-21-22)11-24-18-19-16-5-3-4-6-17(16)23-18/h3-10H,11H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 4.35E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50016432
![PNG](/data/jpeg/tenK5001/BindingDB_50016432.png) (CHEMBL3264692)Show InChI InChI=1S/C16H11ClN4OS/c17-11-4-3-5-13(8-11)21-9-12(19-20-21)10-23-16-18-14-6-1-2-7-15(14)22-16/h1-9H,10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.63E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jamia Hamdard (Hamdard University)
Curated by ChEMBL
| Assay Description Inhibition of COX-2 (unknown origin) |
Eur J Med Chem 81: 204-17 (2014)
Article DOI: 10.1016/j.ejmech.2014.05.012 BindingDB Entry DOI: 10.7270/Q2GM88VQ |
More data for this Ligand-Target Pair | |