Found 21 hits Enz. Inhib. hit(s) with all data for entry = 50045101 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)) | BDBM50045060
(CHEMBL3309789)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1 Show InChI InChI=1S/C23H18INO7/c1-2-32-23(31)20(27)10-19(26)14-5-3-4-13(8-14)11-25-12-17(22(29)30)21(28)16-9-15(24)6-7-18(16)25/h3-10,12,27H,2,11H2,1H3,(H,29,30)/b20-10- | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Competitive inhibition of PTP1B (unknown origin) using pNPP as substrate by Lineweaver-Burk plot |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045048
(CHEMBL3309766)Show SMILES O\C(=C\C(=O)c1cccc(c1)N(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCN(CC1)C(=O)C(\O)=C\C(=O)c1cccc(c1)N(Cc1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C52H48N4O6/c57-47(43-23-13-25-45(31-43)55(35-39-15-5-1-6-16-39)36-40-17-7-2-8-18-40)33-49(59)51(61)53-27-29-54(30-28-53)52(62)50(60)34-48(58)44-24-14-26-46(32-44)56(37-41-19-9-3-10-20-41)38-42-21-11-4-12-22-42/h1-26,31-34,59-60H,27-30,35-38H2/b49-33-,50-34+ | 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 | 2.80E+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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045061
(CHEMBL3309790)Show SMILES OC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1 Show InChI InChI=1S/C21H14INO7/c22-13-4-5-16-14(7-13)19(26)15(20(27)28)10-23(16)9-11-2-1-3-12(6-11)17(24)8-18(25)21(29)30/h1-8,10,25H,9H2,(H,27,28)(H,29,30)/b18-8- | 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 | 4.62E+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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045060
(CHEMBL3309789)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1 Show InChI InChI=1S/C23H18INO7/c1-2-32-23(31)20(27)10-19(26)14-5-3-4-13(8-14)11-25-12-17(22(29)30)21(28)16-9-15(24)6-7-18(16)25/h3-10,12,27H,2,11H2,1H3,(H,29,30)/b20-10- | 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 | 5.66E+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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50045061
(CHEMBL3309790)Show SMILES OC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1 Show InChI InChI=1S/C21H14INO7/c22-13-4-5-16-14(7-13)19(26)15(20(27)28)10-23(16)9-11-2-1-3-12(6-11)17(24)8-18(25)21(29)30/h1-8,10,25H,9H2,(H,27,28)(H,29,30)/b18-8- | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of TCPTP (unknown origin) using pNPP as substrate by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 6
(Homo sapiens (Human)) | BDBM50045061
(CHEMBL3309790)Show SMILES OC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1 Show InChI InChI=1S/C21H14INO7/c22-13-4-5-16-14(7-13)19(26)15(20(27)28)10-23(16)9-11-2-1-3-12(6-11)17(24)8-18(25)21(29)30/h1-8,10,25H,9H2,(H,27,28)(H,29,30)/b18-8- | 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 | 9.82E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of SHP1 (unknown origin) using 3-o-methylfluorescein phosphatase substrate by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 2
(Homo sapiens (Human)) | BDBM50045060
(CHEMBL3309789)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1 Show InChI InChI=1S/C23H18INO7/c1-2-32-23(31)20(27)10-19(26)14-5-3-4-13(8-14)11-25-12-17(22(29)30)21(28)16-9-15(24)6-7-18(16)25/h3-10,12,27H,2,11H2,1H3,(H,29,30)/b20-10- | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.15E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of TCPTP (unknown origin) using pNPP as substrate by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045063
(CHEMBL3309792)Show SMILES COC(=O)c1c(O)cccc1OCCCNC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(cc2c1=O)[N+]([O-])=O Show InChI InChI=1S/C28H24FN3O8/c1-39-28(36)25-23(33)4-2-5-24(25)40-13-3-12-30-27(35)21-16-31(15-17-6-8-18(29)9-7-17)22-11-10-19(32(37)38)14-20(22)26(21)34/h2,4-11,14,16,33H,3,12-13,15H2,1H3,(H,30,35) | 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 | 1.18E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 6
(Homo sapiens (Human)) | BDBM50045060
(CHEMBL3309789)Show SMILES CCOC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1 Show InChI InChI=1S/C23H18INO7/c1-2-32-23(31)20(27)10-19(26)14-5-3-4-13(8-14)11-25-12-17(22(29)30)21(28)16-9-15(24)6-7-18(16)25/h3-10,12,27H,2,11H2,1H3,(H,29,30)/b20-10- | 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 | 1.24E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description
Inhibition of SHP1 (unknown origin) using 3-o-methylfluorescein phosphatase substrate by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045058
(CHEMBL3309787)Show SMILES COC(=O)c1cc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)ccc1O Show InChI InChI=1S/C19H14INO6/c1-27-19(26)13-6-10(2-5-16(13)22)8-21-9-14(18(24)25)17(23)12-7-11(20)3-4-15(12)21/h2-7,9,22H,8H2,1H3,(H,24,25) | 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 | 1.69E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045062
(CHEMBL3309791)Show SMILES COC(=O)c1c(O)cccc1OCCCNC(=O)c1cn(Cc2ccccc2)c2cc(F)ccc2c1=O Show InChI InChI=1S/C28H25FN2O6/c1-36-28(35)25-23(32)9-5-10-24(25)37-14-6-13-30-27(34)21-17-31(16-18-7-3-2-4-8-18)22-15-19(29)11-12-20(22)26(21)33/h2-5,7-12,15,17,32H,6,13-14,16H2,1H3,(H,30,34) | 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 | 1.86E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045049
(CHEMBL3309767)Show SMILES OC(=O)C(\O)=C\C(=O)c1cccc(CN(Cc2ccccc2)Cc2ccccc2)c1 Show InChI InChI=1S/C25H23NO4/c27-23(15-24(28)25(29)30)22-13-7-12-21(14-22)18-26(16-19-8-3-1-4-9-19)17-20-10-5-2-6-11-20/h1-15,28H,16-18H2,(H,29,30)/b24-15- | 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 | 2.00E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045053
(CHEMBL3309776)Show SMILES OC(=O)c1cn(C2CC2)c2ccc(cc2c1=O)N1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C24H25N3O3/c28-23-20-14-19(8-9-22(20)27(18-6-7-18)16-21(23)24(29)30)26-12-10-25(11-13-26)15-17-4-2-1-3-5-17/h1-5,8-9,14,16,18H,6-7,10-13,15H2,(H,29,30) | 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 | 2.28E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045051
(CHEMBL3309773)Show InChI InChI=1S/C20H17NO3/c22-19-16-11-14(10-13-4-2-1-3-5-13)6-9-18(16)21(15-7-8-15)12-17(19)20(23)24/h1-6,9,11-12,15H,7-8,10H2,(H,23,24) | 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 | 2.34E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045054
(CHEMBL3309777)Show SMILES Ic1ccc2n(cc(C(=O)OCc3ccccc3)c(=O)c2c1)C1CC1 Show InChI InChI=1S/C20H16INO3/c21-14-6-9-18-16(10-14)19(23)17(11-22(18)15-7-8-15)20(24)25-12-13-4-2-1-3-5-13/h1-6,9-11,15H,7-8,12H2 | 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 | 2.56E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045056
(CHEMBL3309783)Show SMILES Ic1ccc2n(Cc3ccccc3)cc(C(=O)NCc3ccccc3)c(=O)c2c1 Show InChI InChI=1S/C24H19IN2O2/c25-19-11-12-22-20(13-19)23(28)21(16-27(22)15-18-9-5-2-6-10-18)24(29)26-14-17-7-3-1-4-8-17/h1-13,16H,14-15H2,(H,26,29) | 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 | 2.81E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045055
(CHEMBL3309778)Show SMILES Fc1ccc(COC(=O)c2cn(C3CC3)c3ccc(Cc4ccc(F)cc4)cc3c2=O)cc1 Show InChI InChI=1S/C27H21F2NO3/c28-20-6-1-17(2-7-20)13-19-5-12-25-23(14-19)26(31)24(15-30(25)22-10-11-22)27(32)33-16-18-3-8-21(29)9-4-18/h1-9,12,14-15,22H,10-11,13,16H2 | 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 | 3.14E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045059
(CHEMBL3309788)Show SMILES COC(=O)c1cc(Cn2cc(C(=O)NCc3ccccc3)c(=O)c3cc(I)ccc23)ccc1OC Show InChI InChI=1S/C27H23IN2O5/c1-34-24-11-8-18(12-21(24)27(33)35-2)15-30-16-22(25(31)20-13-19(28)9-10-23(20)30)26(32)29-14-17-6-4-3-5-7-17/h3-13,16H,14-15H2,1-2H3,(H,29,32) | 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 | >3.43E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045052
(CHEMBL3309774)Show SMILES OC(=O)c1cn(C2CC2)c2ccc(Cc3ccc(F)cc3)cc2c1=O Show InChI InChI=1S/C20H16FNO3/c21-14-4-1-12(2-5-14)9-13-3-8-18-16(10-13)19(23)17(20(24)25)11-22(18)15-6-7-15/h1-5,8,10-11,15H,6-7,9H2,(H,24,25) | 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 | 3.64E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045057
(CHEMBL3309786)Show SMILES COC(=O)c1cc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)ccc1OC Show InChI InChI=1S/C20H16INO6/c1-27-17-6-3-11(7-14(17)20(26)28-2)9-22-10-15(19(24)25)18(23)13-8-12(21)4-5-16(13)22/h3-8,10H,9H2,1-2H3,(H,24,25) | 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 | >4.05E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50045064
(CHEMBL3309793)Show SMILES COC(=O)c1c(OCCCN2CCN(CC2)c2ccc3n(cc(C(O)=O)c(=O)c3c2)C2CC2)cccc1OCc1ccccc1 Show InChI InChI=1S/C35H37N3O7/c1-43-35(42)32-30(9-5-10-31(32)45-23-24-7-3-2-4-8-24)44-20-6-15-36-16-18-37(19-17-36)26-13-14-29-27(21-26)33(39)28(34(40)41)22-38(29)25-11-12-25/h2-5,7-10,13-14,21-22,25H,6,11-12,15-20,23H2,1H3,(H,40,41) | 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 | 7.38E+4 | 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 by colorimetric assay |
Bioorg Med Chem 22: 3670-83 (2014)
Article DOI: 10.1016/j.bmc.2014.05.028
BindingDB Entry DOI: 10.7270/Q2G44RX2 |
More data for this
Ligand-Target Pair | |
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