Found 20 hits Enz. Inhib. hit(s) with all data for entry = 50033819 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)) | BDBM50351999
(CHEMBL1822607)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C43H43N3O13/c1-53-43-38(59-42(52)30-18-10-4-11-19-30)37(58-41(51)29-16-8-3-9-17-29)36(57-40(50)28-14-6-2-7-15-28)35(56-43)27-54-26-31-25-46(45-44-31)22-12-5-13-23-55-32-20-21-34(47)33(24-32)39(48)49/h2-4,6-11,14-21,24-25,35-38,43,47H,5,12-13,22-23,26-27H2,1H3,(H,48,49)/t35-,36-,37+,38-,43+/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 | 6.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50351998
(CHEMBL1822606)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C42H41N3O13/c1-52-42-37(58-41(51)29-17-9-4-10-18-29)36(57-40(50)28-15-7-3-8-16-28)35(56-39(49)27-13-5-2-6-14-27)34(55-42)26-53-25-30-24-45(44-43-30)21-11-12-22-54-31-19-20-33(46)32(23-31)38(47)48/h2-10,13-20,23-24,34-37,42,46H,11-12,21-22,25-26H2,1H3,(H,47,48)/t34-,35-,36+,37-,42+/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 | 8.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50352002
(CHEMBL1822610)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCCOc3cc(O)cc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C43H43N3O13/c1-53-43-38(59-42(52)30-18-10-4-11-19-30)37(58-41(51)29-16-8-3-9-17-29)36(57-40(50)28-14-6-2-7-15-28)35(56-43)27-54-26-32-25-46(45-44-32)20-12-5-13-21-55-34-23-31(39(48)49)22-33(47)24-34/h2-4,6-11,14-19,22-25,35-38,43,47H,5,12-13,20-21,26-27H2,1H3,(H,48,49)/t35-,36-,37+,38-,43+/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 | 1.66E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50352001
(CHEMBL1822609)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCOc3cc(O)cc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C42H41N3O13/c1-52-42-37(58-41(51)29-17-9-4-10-18-29)36(57-40(50)28-15-7-3-8-16-28)35(56-39(49)27-13-5-2-6-14-27)34(55-42)26-53-25-31-24-45(44-43-31)19-11-12-20-54-33-22-30(38(47)48)21-32(46)23-33/h2-10,13-18,21-24,34-37,42,46H,11-12,19-20,25-26H2,1H3,(H,47,48)/t34-,35-,36+,37-,42+/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 | 1.93E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50352000
(CHEMBL1822608)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCOc3cc(O)cc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C41H39N3O13/c1-51-41-36(57-40(50)28-16-9-4-10-17-28)35(56-39(49)27-14-7-3-8-15-27)34(55-38(48)26-12-5-2-6-13-26)33(54-41)25-52-24-30-23-44(43-42-30)18-11-19-53-32-21-29(37(46)47)20-31(45)22-32/h2-10,12-17,20-23,33-36,41,45H,11,18-19,24-25H2,1H3,(H,46,47)/t33-,34-,35+,36-,41+/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 | 1.97E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50351999
(CHEMBL1822607)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C43H43N3O13/c1-53-43-38(59-42(52)30-18-10-4-11-19-30)37(58-41(51)29-16-8-3-9-17-29)36(57-40(50)28-14-6-2-7-15-28)35(56-43)27-54-26-31-25-46(45-44-31)22-12-5-13-23-55-32-20-21-34(47)33(24-32)39(48)49/h2-4,6-11,14-21,24-25,35-38,43,47H,5,12-13,22-23,26-27H2,1H3,(H,48,49)/t35-,36-,37+,38-,43+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human TCPTP by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50351998
(CHEMBL1822606)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C42H41N3O13/c1-52-42-37(58-41(51)29-17-9-4-10-18-29)36(57-40(50)28-15-7-3-8-16-28)35(56-39(49)27-13-5-2-6-14-27)34(55-42)26-53-25-30-24-45(44-43-30)21-11-12-22-54-31-19-20-33(46)32(23-31)38(47)48/h2-10,13-20,23-24,34-37,42,46H,11-12,21-22,25-26H2,1H3,(H,47,48)/t34-,35-,36+,37-,42+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
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 |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human TCPTP by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50351997
(CHEMBL1822605)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C41H39N3O13/c1-51-41-36(57-40(50)28-16-9-4-10-17-28)35(56-39(49)27-14-7-3-8-15-27)34(55-38(48)26-12-5-2-6-13-26)33(54-41)25-52-24-29-23-44(43-42-29)20-11-21-53-30-18-19-32(45)31(22-30)37(46)47/h2-10,12-19,22-23,33-36,41,45H,11,20-21,24-25H2,1H3,(H,46,47)/t33-,34-,35+,36-,41+/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 | 2.89E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 11
(Homo sapiens (Human)) | BDBM50351999
(CHEMBL1822607)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C43H43N3O13/c1-53-43-38(59-42(52)30-18-10-4-11-19-30)37(58-41(51)29-16-8-3-9-17-29)36(57-40(50)28-14-6-2-7-15-28)35(56-43)27-54-26-31-25-46(45-44-31)22-12-5-13-23-55-32-20-21-34(47)33(24-32)39(48)49/h2-4,6-11,14-21,24-25,35-38,43,47H,5,12-13,22-23,26-27H2,1H3,(H,48,49)/t35-,36-,37+,38-,43+/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 | 3.45E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human SHP2 by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50351996
(CHEMBL1822604)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCCOc3cccc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C43H43N3O12/c1-52-43-38(58-42(51)31-19-10-4-11-20-31)37(57-41(50)30-17-8-3-9-18-30)36(56-40(49)29-15-6-2-7-16-29)35(55-43)28-53-27-33-26-46(45-44-33)23-12-5-13-24-54-34-22-14-21-32(25-34)39(47)48/h2-4,6-11,14-22,25-26,35-38,43H,5,12-13,23-24,27-28H2,1H3,(H,47,48)/t35-,36-,37+,38-,43+/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 | 3.87E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 6
(Homo sapiens (Human)) | BDBM50351999
(CHEMBL1822607)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C43H43N3O13/c1-53-43-38(59-42(52)30-18-10-4-11-19-30)37(58-41(51)29-16-8-3-9-17-29)36(57-40(50)28-14-6-2-7-15-28)35(56-43)27-54-26-31-25-46(45-44-31)22-12-5-13-23-55-32-20-21-34(47)33(24-32)39(48)49/h2-4,6-11,14-21,24-25,35-38,43,47H,5,12-13,22-23,26-27H2,1H3,(H,48,49)/t35-,36-,37+,38-,43+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human SHP1 by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 11
(Homo sapiens (Human)) | BDBM50351998
(CHEMBL1822606)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C42H41N3O13/c1-52-42-37(58-41(51)29-17-9-4-10-18-29)36(57-40(50)28-15-7-3-8-16-28)35(56-39(49)27-13-5-2-6-14-27)34(55-42)26-53-25-30-24-45(44-43-30)21-11-12-22-54-31-19-20-33(46)32(23-31)38(47)48/h2-10,13-20,23-24,34-37,42,46H,11-12,21-22,25-26H2,1H3,(H,47,48)/t34-,35-,36+,37-,42+/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 | 5.43E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human SHP2 by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50351995
(CHEMBL1822603)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCOc3cccc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C42H41N3O12/c1-51-42-37(57-41(50)30-18-9-4-10-19-30)36(56-40(49)29-16-7-3-8-17-29)35(55-39(48)28-14-5-2-6-15-28)34(54-42)27-52-26-32-25-45(44-43-32)22-11-12-23-53-33-21-13-20-31(24-33)38(46)47/h2-10,13-21,24-25,34-37,42H,11-12,22-23,26-27H2,1H3,(H,46,47)/t34-,35-,36+,37-,42+/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 | 6.01E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50351994
(CHEMBL1822602)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCOc3cccc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C41H39N3O12/c1-50-41-36(56-40(49)29-17-9-4-10-18-29)35(55-39(48)28-15-7-3-8-16-28)34(54-38(47)27-13-5-2-6-14-27)33(53-41)26-51-25-31-24-44(43-42-31)21-12-22-52-32-20-11-19-30(23-32)37(45)46/h2-11,13-20,23-24,33-36,41H,12,21-22,25-26H2,1H3,(H,45,46)/t33-,34-,35+,36-,41+/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 | 6.46E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 6
(Homo sapiens (Human)) | BDBM50351998
(CHEMBL1822606)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C42H41N3O13/c1-52-42-37(58-41(51)29-17-9-4-10-18-29)36(57-40(50)28-15-7-3-8-16-28)35(56-39(49)27-13-5-2-6-14-27)34(55-42)26-53-25-30-24-45(44-43-30)21-11-12-22-54-31-19-20-33(46)32(23-31)38(47)48/h2-10,13-20,23-24,34-37,42,46H,11-12,21-22,25-26H2,1H3,(H,47,48)/t34-,35-,36+,37-,42+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.89E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human SHP1 by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50351998
(CHEMBL1822606)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C42H41N3O13/c1-52-42-37(58-41(51)29-17-9-4-10-18-29)36(57-40(50)28-15-7-3-8-16-28)35(56-39(49)27-13-5-2-6-14-27)34(55-42)26-53-25-30-24-45(44-43-30)21-11-12-22-54-31-19-20-33(46)32(23-31)38(47)48/h2-10,13-20,23-24,34-37,42,46H,11-12,21-22,25-26H2,1H3,(H,47,48)/t34-,35-,36+,37-,42+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human LAR catalytic domain 1 by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50336490
(3,5-DIHYDROXYBENZOATE | 3,5-Dihydroxy-benzoic acid...)Show InChI InChI=1S/C7H6O4/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,8-9H,(H,10,11) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50351999
(CHEMBL1822607)Show SMILES CO[C@H]1O[C@H](COCc2cn(CCCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C43H43N3O13/c1-53-43-38(59-42(52)30-18-10-4-11-19-30)37(58-41(51)29-16-8-3-9-17-29)36(57-40(50)28-14-6-2-7-15-28)35(56-43)27-54-26-31-25-46(45-44-31)22-12-5-13-23-55-32-20-21-34(47)33(24-32)39(48)49/h2-4,6-11,14-21,24-25,35-38,43,47H,5,12-13,22-23,26-27H2,1H3,(H,48,49)/t35-,36-,37+,38-,43+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human LAR catalytic domain 1 by high-throughput screening |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50336491
(3-Hydroxy-benzoic acid | 3-Hydroxybenzoate | 3-Hyd...)Show InChI InChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50335808
(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)Show InChI InChI=1S/C7H6O4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,8-9H,(H,10,11) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
East China University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate reader |
Eur J Med Chem 46: 4212-8 (2011)
Article DOI: 10.1016/j.ejmech.2011.06.025
BindingDB Entry DOI: 10.7270/Q2FT8MDS |
More data for this
Ligand-Target Pair | |
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