Found 81 hits with Last Name = 'rajendra prasad' and Initial = 'y' Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM13976
(Aminobenzoic acid analog 5 | CHEMBL116605)Show SMILES CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O Show InChI InChI=1S/C34H37N3O11/c1-4-22-18-21(14-15-25(22)37(31(41)33(44)45)26-11-6-5-10-23(26)32(42)43)19-24(36-20(2)38)30(40)35-16-7-8-17-48-28-13-9-12-27(39)29(28)34(46)47-3/h5-6,9-15,18,24,39H,4,7-8,16-17,19H2,1-3H3,(H,35,40)(H,36,38)(H,42,43)(H,44,45) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM13976
(Aminobenzoic acid analog 5 | CHEMBL116605)Show SMILES CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O Show InChI InChI=1S/C34H37N3O11/c1-4-22-18-21(14-15-25(22)37(31(41)33(44)45)26-11-6-5-10-23(26)32(42)43)19-24(36-20(2)38)30(40)35-16-7-8-17-48-28-13-9-12-27(39)29(28)34(46)47-3/h5-6,9-15,18,24,39H,4,7-8,16-17,19H2,1-3H3,(H,35,40)(H,36,38)(H,42,43)(H,44,45) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 65 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296368
(7-(biphenyl-4-yl)-4-oxo-4H-chromene-3-carbaldehyde...)Show InChI InChI=1S/C22H14O3/c23-13-19-14-25-21-12-18(10-11-20(21)22(19)24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-14H | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50133280
(5-(3-(3-(3-hydroxy-2-(methoxycarbonyl)phenoxy)prop...)Show SMILES COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O Show InChI InChI=1S/C21H17NO7/c1-27-21(26)19-16(23)8-3-9-17(19)28-10-4-6-13-5-2-7-14(11-13)18-12-15(20(24)25)22-29-18/h2-9,11-12,23H,10H2,1H3,(H,24,25)/b6-4+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | 3D Structure (docked) |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296368
(7-(biphenyl-4-yl)-4-oxo-4H-chromene-3-carbaldehyde...)Show InChI InChI=1S/C22H14O3/c23-13-19-14-25-21-12-18(10-11-20(21)22(19)24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-14H | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50133280
(5-(3-(3-(3-hydroxy-2-(methoxycarbonyl)phenoxy)prop...)Show SMILES COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O Show InChI InChI=1S/C21H17NO7/c1-27-21(26)19-16(23)8-3-9-17(19)28-10-4-6-13-5-2-7-14(11-13)18-12-15(20(24)25)22-29-18/h2-9,11-12,23H,10H2,1H3,(H,24,25)/b6-4+ | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296382
((3S)-7-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxamid...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-10-16(18(21)22)23-11-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15-,16+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 51.6 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296381
((3S)-6-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxamid...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSS3)ccc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-11-23-16(18(21)22)10-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15-,16+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296380
((3S)-7-[4-(1,2-Dithiolan-3-yl)butylcarboxamido]-is...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCCC3CCSS3)cc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-10-16(18(21)22)23-11-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15?,16-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 95.7 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296379
((3S)-6-[4-(1,2-Dithiolan-3-yl)butylcarboxamido]-is...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCCC3CCSS3)ccc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-11-23-16(18(21)22)10-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15?,16-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 104 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296391
((2S)-3-(4-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxa...)Show SMILES CCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r| Show InChI InChI=1S/C19H27NO4S2/c1-2-24-17(19(22)23)13-14-7-9-15(10-8-14)20-18(21)6-4-3-5-16-11-12-25-26-16/h7-10,16-17H,2-6,11-13H2,1H3,(H,20,21)(H,22,23)/t16-,17+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 113 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296386
((3S)-7-{4-[(4R)-1,3-Dithian-4-yl]butylcarboxamido}...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSCS3)cc2CO1 |r| Show InChI InChI=1S/C19H25NO4S2/c21-18(4-2-1-3-16-7-8-25-12-26-16)20-15-6-5-13-10-17(19(22)23)24-11-14(13)9-15/h5-6,9,16-17H,1-4,7-8,10-12H2,(H,20,21)(H,22,23)/t16-,17+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 114 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296376
((3S)-7-[4-(2,2-Dimethyl-1,3-dithiolan-4-yl)butylca...)Show SMILES CC1(C)SCC(CCCCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C20H27NO4S2/c1-20(2)26-12-16(27-20)5-3-4-6-18(22)21-15-8-7-13-10-17(19(23)24)25-11-14(13)9-15/h7-9,16-17H,3-6,10-12H2,1-2H3,(H,21,22)(H,23,24)/t16?,17-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 136 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296390
((2S)-3-(4-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxa...)Show SMILES CO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r| Show InChI InChI=1S/C18H25NO4S2/c1-23-16(18(21)22)12-13-6-8-14(9-7-13)19-17(20)5-3-2-4-15-10-11-24-25-15/h6-9,15-16H,2-5,10-12H2,1H3,(H,19,20)(H,21,22)/t15-,16+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 149 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296375
((3S)-6-[4-(2,2-Dimethyl-1,3-dithiolan-4-yl)butylca...)Show SMILES CC1(C)SCC(CCCCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C20H27NO4S2/c1-20(2)26-12-16(27-20)5-3-4-6-18(22)21-15-8-7-13-11-25-17(19(23)24)10-14(13)9-15/h7-9,16-17H,3-6,10-12H2,1-2H3,(H,21,22)(H,23,24)/t16?,17-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 165 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296385
((3S)-6-{4-[(4R)-1,3-Dithian-4-yl]butylcarboxamido}...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSCS3)ccc2CO1 |r| Show InChI InChI=1S/C19H25NO4S2/c21-18(4-2-1-3-16-7-8-25-12-26-16)20-15-6-5-13-11-24-17(19(22)23)10-14(13)9-15/h5-6,9,16-17H,1-4,7-8,10-12H2,(H,20,21)(H,22,23)/t16-,17+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 167 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296389
((3S)-7-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxamid...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2C(=O)O1 |r| Show InChI InChI=1S/C18H21NO5S2/c20-16(4-2-1-3-13-7-8-25-26-13)19-12-6-5-11-9-15(17(21)22)24-18(23)14(11)10-12/h5-6,10,13,15H,1-4,7-9H2,(H,19,20)(H,21,22)/t13-,15+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 304 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296376
((3S)-7-[4-(2,2-Dimethyl-1,3-dithiolan-4-yl)butylca...)Show SMILES CC1(C)SCC(CCCCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C20H27NO4S2/c1-20(2)26-12-16(27-20)5-3-4-6-18(22)21-15-8-7-13-10-17(19(23)24)25-11-14(13)9-15/h7-9,16-17H,3-6,10-12H2,1-2H3,(H,21,22)(H,23,24)/t16?,17-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 321 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296375
((3S)-6-[4-(2,2-Dimethyl-1,3-dithiolan-4-yl)butylca...)Show SMILES CC1(C)SCC(CCCCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C20H27NO4S2/c1-20(2)26-12-16(27-20)5-3-4-6-18(22)21-15-8-7-13-11-25-17(19(23)24)10-14(13)9-15/h7-9,16-17H,3-6,10-12H2,1-2H3,(H,21,22)(H,23,24)/t16?,17-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 323 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296374
((3S)-7-[2-(2,2-Dimethyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES CC1(C)SCC(CCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C18H23NO4S2/c1-18(2)24-10-14(25-18)5-6-16(20)19-13-4-3-11-8-15(17(21)22)23-9-12(11)7-13/h3-4,7,14-15H,5-6,8-10H2,1-2H3,(H,19,20)(H,21,22)/t14?,15-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 354 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296393
((2S)-2-Butoxy-3-(4-{4-[(3R)-1,2-dithiolan-3-yl]but...)Show SMILES CCCCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r| Show InChI InChI=1S/C21H31NO4S2/c1-2-3-13-26-19(21(24)25)15-16-8-10-17(11-9-16)22-20(23)7-5-4-6-18-12-14-27-28-18/h8-11,18-19H,2-7,12-15H2,1H3,(H,22,23)(H,24,25)/t18-,19+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 358 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296392
((2S)-3-(4-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxa...)Show SMILES CCCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r| Show InChI InChI=1S/C20H29NO4S2/c1-2-12-25-18(20(23)24)14-15-7-9-16(10-8-15)21-19(22)6-4-3-5-17-11-13-26-27-17/h7-10,17-18H,2-6,11-14H2,1H3,(H,21,22)(H,23,24)/t17-,18+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 374 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296375
((3S)-6-[4-(2,2-Dimethyl-1,3-dithiolan-4-yl)butylca...)Show SMILES CC1(C)SCC(CCCCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C20H27NO4S2/c1-20(2)26-12-16(27-20)5-3-4-6-18(22)21-15-8-7-13-11-25-17(19(23)24)10-14(13)9-15/h7-9,16-17H,3-6,10-12H2,1-2H3,(H,21,22)(H,23,24)/t16?,17-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 380 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296376
((3S)-7-[4-(2,2-Dimethyl-1,3-dithiolan-4-yl)butylca...)Show SMILES CC1(C)SCC(CCCCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C20H27NO4S2/c1-20(2)26-12-16(27-20)5-3-4-6-18(22)21-15-8-7-13-10-17(19(23)24)25-11-14(13)9-15/h7-9,16-17H,3-6,10-12H2,1-2H3,(H,21,22)(H,23,24)/t16?,17-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 382 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296370
((3S)-7-[4-(2-Thienyl)butylcarboxamido]-isochroman-...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCCc3cccs3)cc2CO1 |r| Show InChI InChI=1S/C19H21NO4S/c21-18(6-2-1-4-16-5-3-9-25-16)20-15-8-7-13-11-17(19(22)23)24-12-14(13)10-15/h3,5,7-10,17H,1-2,4,6,11-12H2,(H,20,21)(H,22,23)/t17-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 384 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296373
((3S)-6-[2-(2,2-Dimethyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES CC1(C)SCC(CCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C18H23NO4S2/c1-18(2)24-10-14(25-18)5-6-16(20)19-13-4-3-11-9-23-15(17(21)22)8-12(11)7-13/h3-4,7,14-15H,5-6,8-10H2,1-2H3,(H,19,20)(H,21,22)/t14?,15-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 386 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296374
((3S)-7-[2-(2,2-Dimethyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES CC1(C)SCC(CCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C18H23NO4S2/c1-18(2)24-10-14(25-18)5-6-16(20)19-13-4-3-11-8-15(17(21)22)23-9-12(11)7-13/h3-4,7,14-15H,5-6,8-10H2,1-2H3,(H,19,20)(H,21,22)/t14?,15-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 403 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296369
((3S)-6-[4-(2-Thienyl)-butylcarboxamido]-isochroman...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCCc3cccs3)ccc2CO1 |r| Show InChI InChI=1S/C19H21NO4S/c21-18(6-2-1-4-16-5-3-9-25-16)20-15-8-7-13-12-24-17(19(22)23)11-14(13)10-15/h3,5,7-10,17H,1-2,4,6,11-12H2,(H,20,21)(H,22,23)/t17-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 429 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296373
((3S)-6-[2-(2,2-Dimethyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES CC1(C)SCC(CCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C18H23NO4S2/c1-18(2)24-10-14(25-18)5-6-16(20)19-13-4-3-11-9-23-15(17(21)22)8-12(11)7-13/h3-4,7,14-15H,5-6,8-10H2,1-2H3,(H,19,20)(H,21,22)/t14?,15-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL 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 |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296374
((3S)-7-[2-(2,2-Dimethyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES CC1(C)SCC(CCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C18H23NO4S2/c1-18(2)24-10-14(25-18)5-6-16(20)19-13-4-3-11-8-15(17(21)22)23-9-12(11)7-13/h3-4,7,14-15H,5-6,8-10H2,1-2H3,(H,19,20)(H,21,22)/t14?,15-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 458 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296373
((3S)-6-[2-(2,2-Dimethyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES CC1(C)SCC(CCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r| Show InChI InChI=1S/C18H23NO4S2/c1-18(2)24-10-14(25-18)5-6-16(20)19-13-4-3-11-9-23-15(17(21)22)8-12(11)7-13/h3-4,7,14-15H,5-6,8-10H2,1-2H3,(H,19,20)(H,21,22)/t14?,15-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 493 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296372
((3S)-7-[3-(2-Thienyl)propylcarboxamido]-isochroman...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCc3cccs3)cc2CO1 |r| Show InChI InChI=1S/C18H19NO4S/c20-17(5-1-3-15-4-2-8-24-15)19-14-7-6-12-10-16(18(21)22)23-11-13(12)9-14/h2,4,6-9,16H,1,3,5,10-11H2,(H,19,20)(H,21,22)/t16-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 510 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296388
((3S)-7-{4-[(4R)-2,2-Diphenyl-1,3-dithian-4-yl]buty...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSC(S3)(c3ccccc3)c3ccccc3)cc2CO1 |r| Show InChI InChI=1S/C31H33NO4S2/c33-29(32-26-16-15-22-20-28(30(34)35)36-21-23(22)19-26)14-8-7-13-27-17-18-37-31(38-27,24-9-3-1-4-10-24)25-11-5-2-6-12-25/h1-6,9-12,15-16,19,27-28H,7-8,13-14,17-18,20-21H2,(H,32,33)(H,34,35)/t27-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 519 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296372
((3S)-7-[3-(2-Thienyl)propylcarboxamido]-isochroman...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCc3cccs3)cc2CO1 |r| Show InChI InChI=1S/C18H19NO4S/c20-17(5-1-3-15-4-2-8-24-15)19-14-7-6-12-10-16(18(21)22)23-11-13(12)9-14/h2,4,6-9,16H,1,3,5,10-11H2,(H,19,20)(H,21,22)/t16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296371
((3S)-6-[3-(2-Thienyl)propylcarboxamido]-isochroman...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCc3cccs3)ccc2CO1 |r| Show InChI InChI=1S/C18H19NO4S/c20-17(5-1-3-15-4-2-8-24-15)19-14-7-6-12-11-23-16(18(21)22)10-13(12)9-14/h2,4,6-9,16H,1,3,5,10-11H2,(H,19,20)(H,21,22)/t16-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 553 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296387
((3S)-6-{4-[(4R)-2,2-Diphenyl-1,3-dithian-4-yl]buty...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSC(S3)(c3ccccc3)c3ccccc3)ccc2CO1 |r| Show InChI InChI=1S/C31H33NO4S2/c33-29(32-26-16-15-22-21-36-28(30(34)35)20-23(22)19-26)14-8-7-13-27-17-18-37-31(38-27,24-9-3-1-4-10-24)25-11-5-2-6-12-25/h1-6,9-12,15-16,19,27-28H,7-8,13-14,17-18,20-21H2,(H,32,33)(H,34,35)/t27-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 567 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296372
((3S)-7-[3-(2-Thienyl)propylcarboxamido]-isochroman...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCc3cccs3)cc2CO1 |r| Show InChI InChI=1S/C18H19NO4S/c20-17(5-1-3-15-4-2-8-24-15)19-14-7-6-12-10-16(18(21)22)23-11-13(12)9-14/h2,4,6-9,16H,1,3,5,10-11H2,(H,19,20)(H,21,22)/t16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 625 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296378
((3S)-7-[2-(2,2-Diphenyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCC3CSC(S3)(c3ccccc3)c3ccccc3)cc2CO1 |r| Show InChI InChI=1S/C28H27NO4S2/c30-26(29-23-12-11-19-16-25(27(31)32)33-17-20(19)15-23)14-13-24-18-34-28(35-24,21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-12,15,24-25H,13-14,16-18H2,(H,29,30)(H,31,32)/t24?,25-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 638 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296377
((3S)-6-[2-(2,2-Diphenyl-1,3-dithiolan-4-yl)ethylca...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCC3CSC(S3)(c3ccccc3)c3ccccc3)ccc2CO1 |r| Show InChI InChI=1S/C28H27NO4S2/c30-26(29-23-12-11-19-17-33-25(27(31)32)16-20(19)15-23)14-13-24-18-34-28(35-24,21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-12,15,24-25H,13-14,16-18H2,(H,29,30)(H,31,32)/t24?,25-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 669 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296371
((3S)-6-[3-(2-Thienyl)propylcarboxamido]-isochroman...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCc3cccs3)ccc2CO1 |r| Show InChI InChI=1S/C18H19NO4S/c20-17(5-1-3-15-4-2-8-24-15)19-14-7-6-12-11-23-16(18(21)22)10-13(12)9-14/h2,4,6-9,16H,1,3,5,10-11H2,(H,19,20)(H,21,22)/t16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 678 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296371
((3S)-6-[3-(2-Thienyl)propylcarboxamido]-isochroman...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCc3cccs3)ccc2CO1 |r| Show InChI InChI=1S/C18H19NO4S/c20-17(5-1-3-15-4-2-8-24-15)19-14-7-6-12-11-23-16(18(21)22)10-13(12)9-14/h2,4,6-9,16H,1,3,5,10-11H2,(H,19,20)(H,21,22)/t16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 765 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296382
((3S)-7-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxamid...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-10-16(18(21)22)23-11-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15-,16+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.82E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296382
((3S)-7-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxamid...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-10-16(18(21)22)23-11-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15-,16+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.94E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296380
((3S)-7-[4-(1,2-Dithiolan-3-yl)butylcarboxamido]-is...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCCC3CCSS3)cc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-10-16(18(21)22)23-11-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15?,16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296379
((3S)-6-[4-(1,2-Dithiolan-3-yl)butylcarboxamido]-is...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCCC3CCSS3)ccc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-11-23-16(18(21)22)10-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15?,16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296380
((3S)-7-[4-(1,2-Dithiolan-3-yl)butylcarboxamido]-is...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCCC3CCSS3)cc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-10-16(18(21)22)23-11-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15?,16-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50296381
((3S)-6-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxamid...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSS3)ccc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-11-23-16(18(21)22)10-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15-,16+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of LAR |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296381
((3S)-6-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxamid...)Show SMILES OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSS3)ccc2CO1 |r| Show InChI InChI=1S/C18H23NO4S2/c20-17(4-2-1-3-15-7-8-24-25-15)19-14-6-5-12-11-23-16(18(21)22)10-13(12)9-14/h5-6,9,15-16H,1-4,7-8,10-11H2,(H,19,20)(H,21,22)/t15-,16+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.55E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50296391
((2S)-3-(4-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxa...)Show SMILES CCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r| Show InChI InChI=1S/C19H27NO4S2/c1-2-24-17(19(22)23)13-14-7-9-15(10-8-14)20-18(21)6-4-3-5-16-11-12-25-26-16/h7-10,16-17H,2-6,11-13H2,1H3,(H,20,21)(H,22,23)/t16-,17+/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.67E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of TCPTP |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50296384
((3S)-7-{4-[(4S)-2-Oxoperhydrothieno-[3,4-d]imidazo...)Show SMILES OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3SCC4NC(=O)NC34)cc2CO1 |r| Show InChI InChI=1S/C20H25N3O5S/c24-17(4-2-1-3-16-18-14(10-29-16)22-20(27)23-18)21-13-6-5-11-8-15(19(25)26)28-9-12(11)7-13/h5-7,14-16,18H,1-4,8-10H2,(H,21,24)(H,25,26)(H2,22,23,27)/t14?,15-,16-,18?/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.75E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Glenmark Research Center
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Eur J Med Chem 44: 3147-57 (2009)
Article DOI: 10.1016/j.ejmech.2009.03.009 BindingDB Entry DOI: 10.7270/Q2FJ2GTG |
More data for this Ligand-Target Pair | |