Found 11 hits of Enzyme Inhibition Constant Data 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)) | BDBM50190664
(CHEMBL3974642)Show SMILES [H][C@@]12CC=C3[C@]([H])(CC[C@@H](C)[C@]3(C)[C@]1([H])C2(C)C)[C@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,t:3| Show InChI InChI=1S/C28H38O5/c1-14(2)11-17(22-24(32)18(12-29)23(31)19(13-30)25(22)33)16-8-7-15(3)28(6)20(16)9-10-21-26(28)27(21,4)5/h9,12-17,21,26,31-33H,7-8,10-11H2,1-6H3/t15-,16-,17+,21-,26+,28+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190671
(CHEMBL3935360)Show SMILES [H][C@@]12CC[C@@H](C)C3=C([C@]1([H])C2(C)C)[C@](C)(CC3)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,c:6| Show InChI InChI=1S/C28H38O5/c1-14(2)11-20(21-25(32)17(12-29)24(31)18(13-30)26(21)33)28(6)10-9-16-15(3)7-8-19-23(22(16)28)27(19,4)5/h12-15,19-20,23,31-33H,7-11H2,1-6H3/t15-,19-,20+,23-,28-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190667
(CHEMBL3944321)Show SMILES [H][C@@]12CC[C@@H](C)C3=CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r,t:6| Show InChI InChI=1S/C28H38O5/c1-14(2)11-20(21-25(32)17(12-29)24(31)18(13-30)26(21)33)28(6)10-9-16-15(3)7-8-19-23(22(16)28)27(19,4)5/h9,12-15,19-20,22-23,31-33H,7-8,10-11H2,1-6H3/t15-,19-,20+,22-,23-,28-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50346601
(NSC-114945 | OLEANOLIC_ACID | Oleanolic acid | Ole...)Show SMILES CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10| Show InChI InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,27-,28+,29+,30-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
KEGG
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 |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190670
(CHEMBL3931387)Show SMILES [H][C@]1(CC[C@H](C)C2=C[C@H](CC[C@@]12C)C(C)=C)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,t:6| Show InChI InChI=1S/C28H38O5/c1-15(2)11-19(24-26(32)20(13-29)25(31)21(14-30)27(24)33)22-8-7-17(5)23-12-18(16(3)4)9-10-28(22,23)6/h12-15,17-19,22,31-33H,3,7-11H2,1-2,4-6H3/t17-,18-,19+,22-,28-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190662
(CHEMBL3916388)Show SMILES [H][C@@]12CC[C@@H](C)C3=CC[C@](C)([C@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r,t:6| Show InChI InChI=1S/C28H38O5/c1-14(2)11-20(21-25(32)17(12-29)24(31)18(13-30)26(21)33)28(6)10-9-16-15(3)7-8-19-23(22(16)28)27(19,4)5/h9,12-15,19-20,22-23,31-33H,7-8,10-11H2,1-6H3/t15-,19-,20-,22-,23-,28-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190666
(CHEMBL3954985)Show SMILES [H][C@@]12CC[C@@](C)(OC)[C@]3([H])CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r| Show InChI InChI=1S/C29H42O6/c1-15(2)12-20(21-25(33)16(13-30)24(32)17(14-31)26(21)34)28(5)10-8-19-23(28)22-18(27(22,3)4)9-11-29(19,6)35-7/h13-15,18-20,22-23,32-34H,8-12H2,1-7H3/t18-,19-,20+,22-,23-,28-,29-/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 | 4.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190665
(CHEMBL3982631)Show SMILES [H][C@]12CC[C@](C)(Cc3c(O)c(C=O)c(O)c(C(=O)CC(C)C)c3O)C1=C[C@@H](CC[C@H]2C)C(C)(C)O |r,c:26| Show InChI InChI=1S/C28H40O6/c1-15(2)11-22(30)23-25(32)19(24(31)20(14-29)26(23)33)13-28(6)10-9-18-16(3)7-8-17(12-21(18)28)27(4,5)34/h12,14-18,31-34H,7-11,13H2,1-6H3/t16-,17-,18-,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 | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190663
(CHEMBL3903731)Show SMILES [H][C@@]12CC=C3[C@]([H])(CC[C@@H](C)[C@]3(C)[C@]1([H])C2(C)C)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,t:3| Show InChI InChI=1S/C28H38O5/c1-14(2)11-17(22-24(32)18(12-29)23(31)19(13-30)25(22)33)16-8-7-15(3)28(6)20(16)9-10-21-26(28)27(21,4)5/h9,12-17,21,26,31-33H,7-8,10-11H2,1-6H3/t15-,16-,17-,21-,26+,28+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190668
(CHEMBL3907420)Show SMILES [H][C@@]12CCC(C)=C3CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r,t:5| Show InChI InChI=1S/C28H38O5/c1-14(2)11-20(21-25(32)17(12-29)24(31)18(13-30)26(21)33)28(6)10-9-16-15(3)7-8-19-23(22(16)28)27(19,4)5/h12-14,19-20,22-23,31-33H,7-11H2,1-6H3/t19-,20+,22-,23-,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 | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50190669
(CHEMBL3983611)Show SMILES [H][C@@]12CC[C@](C)(O)[C@]3([H])CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r| Show InChI InChI=1S/C28H40O6/c1-14(2)11-19(20-24(32)15(12-29)23(31)16(13-30)25(20)33)27(5)9-7-18-22(27)21-17(26(21,3)4)8-10-28(18,6)34/h12-14,17-19,21-22,31-34H,7-11H2,1-6H3/t17-,18-,19+,21-,22-,27-,28+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis |
J Nat Prod 79: 1365-72 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00090
BindingDB Entry DOI: 10.7270/Q27W6F46 |
More data for this
Ligand-Target Pair | |
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