Found 15 hits with Last Name = 'wubshet' and Initial = 'sg' 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)) | BDBM50535803
(CHEMBL4554678)Show SMILES [H][C@@]12CCC=C(C)[C@@]1(C)CC[C@](C)(CC1=C(O)C(=O)C=C(CCCS(O)(=O)=O)C1=O)[C@@H]2C |r,c:15,t:4,20| Show InChI InChI=1S/C24H34O6S/c1-15-7-5-9-19-16(2)23(3,10-11-24(15,19)4)14-18-21(26)17(13-20(25)22(18)27)8-6-12-31(28,29)30/h7,13,16,19,27H,5-6,8-12,14H2,1-4H3,(H,28,29,30)/t16-,19+,23-,24-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535802
(CHEMBL4567748)Show SMILES [H][C@]1(CC[C@@H](C)c2c(O)c(O)c(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)COC(=O)CC(C)C |r| Show InChI InChI=1S/C25H38O6/c1-14(2)11-21(26)31-13-15(3)7-6-8-16(4)18-10-9-17(5)22-19(18)12-20(25(29)30)23(27)24(22)28/h12,14-18,27-28H,6-11,13H2,1-5H3,(H,29,30)/t15-,16+,17-,18+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human PTP1B preincubated for 10 mins followed by protein addition using pNPP substrate |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50374277
(CHEMBL403094)Show SMILES Oc1ccc-2c(c1)[C@@H]1Oc3ccccc3[C@@]3(O)CC(=O)c4c(O)cc(O)c-2c4[C@@H]13 Show InChI InChI=1S/C23H16O6/c24-10-5-6-11-12(7-10)22-21-20-18(11)14(25)8-15(26)19(20)16(27)9-23(21,28)13-3-1-2-4-17(13)29-22/h1-8,21-22,24-26,28H,9H2/t21-,22-,23-/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 | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50374280
(CHEMBL403411)Show SMILES O[C@@H]1[C@H]2[C@@H]3[C@@H](Oc4ccccc24)c2cccc(O)c2-c2c(O)cc(O)c(C1=O)c32 Show InChI InChI=1S/C23H16O6/c24-11-6-3-5-10-15(11)17-12(25)8-13(26)18-19(17)20-16(21(27)22(18)28)9-4-1-2-7-14(9)29-23(10)20/h1-8,16,20-21,23-27H/t16-,20+,21-,23+/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 | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50374279
(OHIOENSIN A)Show SMILES Oc1ccc-2c(c1)[C@@H]1Oc3ccccc3[C@H]3CC(=O)c4c(O)cc(O)c-2c4[C@@H]13 |r| Show InChI InChI=1S/C23H16O5/c24-10-5-6-12-14(7-10)23-20-13(11-3-1-2-4-18(11)28-23)8-15(25)21-17(27)9-16(26)19(12)22(20)21/h1-7,9,13,20,23-24,26-27H,8H2/t13-,20+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| KEGG
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 |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535808
(CHEMBL4524583)Show SMILES [H][C@@]12CC(=O)c3c(O)cc(OC)c4-c5ccc(O)cc5[C@]([H])(Oc5ccccc15)[C@]2([H])c34 |r| Show InChI InChI=1S/C24H18O5/c1-28-19-10-17(27)22-16(26)9-14-12-4-2-3-5-18(12)29-24-15-8-11(25)6-7-13(15)20(19)23(22)21(14)24/h2-8,10,14,21,24-25,27H,9H2,1H3/t14-,21+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50093526
(CHEMBL426373 | RK-682)Show SMILES CCCCCCCCCCCCCCCC(=O)C1=C(O)[C@@H](CO)OC1=O |r,c:17| Show InChI InChI=1S/C21H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(23)19-20(24)18(16-22)26-21(19)25/h18,22,24H,2-16H2,1H3/t18-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human PTP1B preincubated for 10 mins followed by protein addition using pNPP substrate |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535804
(CHEMBL4561426)Show SMILES [H][C@@]1(O[C@H]2[C@H](O)C[C@@H](O)c3ccccc23)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C16H22O8/c17-6-11-12(20)13(21)14(22)16(23-11)24-15-8-4-2-1-3-7(8)9(18)5-10(15)19/h1-4,9-22H,5-6H2/t9-,10-,11-,12-,13+,14-,15-,16+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535805
(CHEMBL4566713)Show SMILES [H][C@@]12[#6]-[#6]-[#6](=[#6])[C@]1([H])[C@@]1([H])[C@]([H])([#6]-[#6][C@@]21[#6])[#6](-[#6])-[#6]-[#6](=O)\[#6]=[#6](\[#6])-[#6] |r| Show InChI InChI=1S/C20H30O/c1-12(2)10-15(21)11-14(4)16-8-9-20(5)17-7-6-13(3)18(17)19(16)20/h10,14,16-19H,3,6-9,11H2,1-2,4-5H3/t14?,16-,17-,18+,19-,20+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535800
(CHEMBL4541029)Show SMILES [H][C@]1(CC[C@@H](C)c2c(O)cc(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)COC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C29H36O5/c1-19(18-34-27(31)15-13-22-10-5-4-6-11-22)8-7-9-20(2)24-14-12-21(3)28-25(24)16-23(29(32)33)17-26(28)30/h4-6,10-11,13,15-17,19-21,24,30H,7-9,12,14,18H2,1-3H3,(H,32,33)/b15-13+/t19-,20+,21-,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human PTP1B preincubated for 10 mins followed by protein addition using pNPP substrate |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50391058
(CHEMBL2086414)Show SMILES C[C@@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O |r,t:3| Show InChI InChI=1S/C30H46O4/c1-18-9-14-30(25(33)34)16-15-28(5)20(24(30)19(18)2)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h7,19,21-24,31-32H,1,8-17H2,2-6H3,(H,33,34)/t19-,21+,22+,23-,24-,26-,27-,28+,29+,30-/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 | 6.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50250341
(23-hydroxyursolic acid | CHEMBL523622)Show SMILES C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9| Show InChI InChI=1S/C30H48O4/c1-18-9-14-30(25(33)34)16-15-28(5)20(24(30)19(18)2)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h7,18-19,21-24,31-32H,8-17H2,1-6H3,(H,33,34)/t18-,19+,21-,22-,23+,24+,26+,27+,28-,29-,30+/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 | 7.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535801
(CHEMBL4528277)Show SMILES [H][C@]1(CC[C@@H](C)c2c(O)c(O)c(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)COC(=O)CCC |r| Show InChI InChI=1S/C24H36O6/c1-5-7-20(25)30-13-14(2)8-6-9-15(3)17-11-10-16(4)21-18(17)12-19(24(28)29)22(26)23(21)27/h12,14-17,26-27H,5-11,13H2,1-4H3,(H,28,29)/t14-,15+,16-,17+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7.67E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human PTP1B preincubated for 10 mins followed by protein addition using pNPP substrate |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535807
(CHEBI:69561 | Lobophytumin C)Show SMILES [H][C@]12[#6]-[#6@H](-[#6]-[#6][C@]1([#6])[#6]-[#6]-[#6]-[#6]2=[#6])-[#6](=[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |r| Show InChI InChI=1S/C20H32/c1-15(2)8-6-9-16(3)18-11-13-20(5)12-7-10-17(4)19(20)14-18/h8,18-19H,3-4,6-7,9-14H2,1-2,5H3/t18-,19+,20-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of GST-tagged human PTP1B expressed in Escherichia coli using pNPP substrate assessed as reduction in p-nitrophenol release |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50535806
(CHEMBL4535279)Show SMILES [H][C@]1(CC[C@@H](C)c2c(O)c(O)c(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)CO |r| Show InChI InChI=1S/C20H30O5/c1-11(10-21)5-4-6-12(2)14-8-7-13(3)17-15(14)9-16(20(24)25)18(22)19(17)23/h9,11-14,21-23H,4-8,10H2,1-3H3,(H,24,25)/t11-,12+,13-,14+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.26E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human PTP1B preincubated for 10 mins followed by protein addition using pNPP substrate |
J Nat Prod 79: 1063-72 (2016)
Article DOI: 10.1021/acs.jnatprod.5b01128
BindingDB Entry DOI: 10.7270/Q2Z89GXC |
More data for this
Ligand-Target Pair | |
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