Found 34 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)) | BDBM50135663
(3-(4-Biphenyl-4-ylmethyl-piperazin-1-ylmethyl)-pyr...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc(cc4)-c4ccccc4)CC3)nnc2n1 Show InChI InChI=1S/C23H25N9/c24-21-20-22(28-23(25)27-21)30-29-19(26-20)15-32-12-10-31(11-13-32)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9H,10-15H2,(H4,24,25,27,28,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135663
(3-(4-Biphenyl-4-ylmethyl-piperazin-1-ylmethyl)-pyr...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc(cc4)-c4ccccc4)CC3)nnc2n1 Show InChI InChI=1S/C23H25N9/c24-21-20-22(28-23(25)27-21)30-29-19(26-20)15-32-12-10-31(11-13-32)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9H,10-15H2,(H4,24,25,27,28,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135667
(3-(4-Naphthalen-2-ylmethyl-piperazin-1-ylmethyl)-p...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc5ccccc5c4)CC3)nnc2n1 Show InChI InChI=1S/C21H23N9/c22-19-18-20(26-21(23)25-19)28-27-17(24-18)13-30-9-7-29(8-10-30)12-14-5-6-15-3-1-2-4-16(15)11-14/h1-6,11H,7-10,12-13H2,(H4,22,23,25,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135670
(3-(4-Naphthalen-1-ylmethyl-piperazin-1-ylmethyl)-p...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4cccc5ccccc45)CC3)nnc2n1 Show InChI InChI=1S/C21H23N9/c22-19-18-20(26-21(23)25-19)28-27-17(24-18)13-30-10-8-29(9-11-30)12-15-6-3-5-14-4-1-2-7-16(14)15/h1-7H,8-13H2,(H4,22,23,25,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 11
(Homo sapiens (Human)) | BDBM50135663
(3-(4-Biphenyl-4-ylmethyl-piperazin-1-ylmethyl)-pyr...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc(cc4)-c4ccccc4)CC3)nnc2n1 Show InChI InChI=1S/C23H25N9/c24-21-20-22(28-23(25)27-21)30-29-19(26-20)15-32-12-10-31(11-13-32)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9H,10-15H2,(H4,24,25,27,28,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Tyrosine phosphatase SHP-2 in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135668
(3-(4-Benzyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C17H21N9/c18-15-14-16(22-17(19)21-15)24-23-13(20-14)11-26-8-6-25(7-9-26)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H4,18,19,21,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 6.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135668
(3-(4-Benzyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C17H21N9/c18-15-14-16(22-17(19)21-15)24-23-13(20-14)11-26-8-6-25(7-9-26)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H4,18,19,21,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 6.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 11
(Homo sapiens (Human)) | BDBM50135668
(3-(4-Benzyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C17H21N9/c18-15-14-16(22-17(19)21-15)24-23-13(20-14)11-26-8-6-25(7-9-26)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H4,18,19,21,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 9.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Tyrosine phosphatase SHP-2 in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50135668
(3-(4-Benzyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C17H21N9/c18-15-14-16(22-17(19)21-15)24-23-13(20-14)11-26-8-6-25(7-9-26)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H4,18,19,21,22,24) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Leukocyte antigen related receptor phosphatase (LAR) in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 11
(Homo sapiens (Human)) | BDBM50135673
(3-Diethylaminomethyl-pyrimido[5,4-e][1,2,4]triazin...)Show InChI InChI=1S/C10H16N8/c1-3-18(4-2)5-6-13-7-8(11)14-10(12)15-9(7)17-16-6/h3-5H2,1-2H3,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Tyrosine phosphatase SHP-2 in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase alpha
(Homo sapiens (Human)) | BDBM50135663
(3-(4-Biphenyl-4-ylmethyl-piperazin-1-ylmethyl)-pyr...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc(cc4)-c4ccccc4)CC3)nnc2n1 Show InChI InChI=1S/C23H25N9/c24-21-20-22(28-23(25)27-21)30-29-19(26-20)15-32-12-10-31(11-13-32)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9H,10-15H2,(H4,24,25,27,28,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Protein-tyrosine phosphatase alpha in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50135663
(3-(4-Biphenyl-4-ylmethyl-piperazin-1-ylmethyl)-pyr...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc(cc4)-c4ccccc4)CC3)nnc2n1 Show InChI InChI=1S/C23H25N9/c24-21-20-22(28-23(25)27-21)30-29-19(26-20)15-32-12-10-31(11-13-32)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9H,10-15H2,(H4,24,25,27,28,30) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Leukocyte antigen related receptor phosphatase (LAR) in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135663
(3-(4-Biphenyl-4-ylmethyl-piperazin-1-ylmethyl)-pyr...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc(cc4)-c4ccccc4)CC3)nnc2n1 Show InChI InChI=1S/C23H25N9/c24-21-20-22(28-23(25)27-21)30-29-19(26-20)15-32-12-10-31(11-13-32)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9H,10-15H2,(H4,24,25,27,28,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135672
(3-(4-Methyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C11H17N9/c1-19-2-4-20(5-3-19)6-7-14-8-9(12)15-11(13)16-10(8)18-17-7/h2-6H2,1H3,(H4,12,13,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase alpha
(Homo sapiens (Human)) | BDBM50135668
(3-(4-Benzyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C17H21N9/c18-15-14-16(22-17(19)21-15)24-23-13(20-14)11-26-8-6-25(7-9-26)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H4,18,19,21,22,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Protein-tyrosine phosphatase alpha in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135664
(3-Morpholin-4-ylmethyl-pyrimido[5,4-e][1,2,4]triaz...)Show InChI InChI=1S/C10H14N8O/c11-8-7-9(15-10(12)14-8)17-16-6(13-7)5-18-1-3-19-4-2-18/h1-5H2,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135669
(3-Piperidin-1-ylmethyl-pyrimido[5,4-e][1,2,4]triaz...)Show InChI InChI=1S/C11H16N8/c12-9-8-10(16-11(13)15-9)18-17-7(14-8)6-19-4-2-1-3-5-19/h1-6H2,(H4,12,13,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase F
(Homo sapiens (Human)) | BDBM50135673
(3-Diethylaminomethyl-pyrimido[5,4-e][1,2,4]triazin...)Show InChI InChI=1S/C10H16N8/c1-3-18(4-2)5-6-13-7-8(11)14-10(12)15-9(7)17-16-6/h3-5H2,1-2H3,(H4,11,12,14,15,17) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Leukocyte antigen related receptor phosphatase (LAR) in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Receptor-type tyrosine-protein phosphatase alpha
(Homo sapiens (Human)) | BDBM50135673
(3-Diethylaminomethyl-pyrimido[5,4-e][1,2,4]triazin...)Show InChI InChI=1S/C10H16N8/c1-3-18(4-2)5-6-13-7-8(11)14-10(12)15-9(7)17-16-6/h3-5H2,1-2H3,(H4,11,12,14,15,17) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
In vitro inhibitory concentration required against Protein-tyrosine phosphatase alpha in the presence of 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135673
(3-Diethylaminomethyl-pyrimido[5,4-e][1,2,4]triazin...)Show InChI InChI=1S/C10H16N8/c1-3-18(4-2)5-6-13-7-8(11)14-10(12)15-9(7)17-16-6/h3-5H2,1-2H3,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135673
(3-Diethylaminomethyl-pyrimido[5,4-e][1,2,4]triazin...)Show InChI InChI=1S/C10H16N8/c1-3-18(4-2)5-6-13-7-8(11)14-10(12)15-9(7)17-16-6/h3-5H2,1-2H3,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135671
(3-Piperazin-1-ylmethyl-pyrimido[5,4-e][1,2,4]triaz...)Show InChI InChI=1S/C10H15N9/c11-8-7-9(16-10(12)15-8)18-17-6(14-7)5-19-3-1-13-2-4-19/h13H,1-5H2,(H4,11,12,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135667
(3-(4-Naphthalen-2-ylmethyl-piperazin-1-ylmethyl)-p...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4ccc5ccccc5c4)CC3)nnc2n1 Show InChI InChI=1S/C21H23N9/c22-19-18-20(26-21(23)25-19)28-27-17(24-18)13-30-9-7-29(8-10-30)12-14-5-6-15-3-1-2-4-16(15)11-14/h1-6,11H,7-10,12-13H2,(H4,22,23,25,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135670
(3-(4-Naphthalen-1-ylmethyl-piperazin-1-ylmethyl)-p...)Show SMILES Nc1nc(N)c2nc(CN3CCN(Cc4cccc5ccccc45)CC3)nnc2n1 Show InChI InChI=1S/C21H23N9/c22-19-18-20(26-21(23)25-19)28-27-17(24-18)13-30-10-8-29(9-11-30)12-15-6-3-5-14-4-1-2-7-16(14)15/h1-7H,8-13H2,(H4,22,23,25,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135672
(3-(4-Methyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C11H17N9/c1-19-2-4-20(5-3-19)6-7-14-8-9(12)15-11(13)16-10(8)18-17-7/h2-6H2,1H3,(H4,12,13,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 8.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135671
(3-Piperazin-1-ylmethyl-pyrimido[5,4-e][1,2,4]triaz...)Show InChI InChI=1S/C10H15N9/c11-8-7-9(16-10(12)15-8)18-17-6(14-7)5-19-3-1-13-2-4-19/h13H,1-5H2,(H4,11,12,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 9.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135666
(2-[(5,7-Diamino-pyrimido[5,4-e][1,2,4]triazin-3-yl...)Show InChI InChI=1S/C10H16N8O2/c11-8-7-9(15-10(12)14-8)17-16-6(13-7)5-18(1-3-19)2-4-20/h19-20H,1-5H2,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 9.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135668
(3-(4-Benzyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C17H21N9/c18-15-14-16(22-17(19)21-15)24-23-13(20-14)11-26-8-6-25(7-9-26)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H4,18,19,21,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 9.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135669
(3-Piperidin-1-ylmethyl-pyrimido[5,4-e][1,2,4]triaz...)Show InChI InChI=1S/C11H16N8/c12-9-8-10(16-11(13)15-9)18-17-7(14-8)6-19-4-2-1-3-5-19/h1-6H2,(H4,12,13,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135665
(3-(4-Phenyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C16H19N9/c17-14-13-15(21-16(18)20-14)23-22-12(19-13)10-24-6-8-25(9-7-24)11-4-2-1-3-5-11/h1-5H,6-10H2,(H4,17,18,20,21,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135673
(3-Diethylaminomethyl-pyrimido[5,4-e][1,2,4]triazin...)Show InChI InChI=1S/C10H16N8/c1-3-18(4-2)5-6-13-7-8(11)14-10(12)15-9(7)17-16-6/h3-5H2,1-2H3,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135665
(3-(4-Phenyl-piperazin-1-ylmethyl)-pyrimido[5,4-e][...)Show InChI InChI=1S/C16H19N9/c17-14-13-15(21-16(18)20-14)23-22-12(19-13)10-24-6-8-25(9-7-24)11-4-2-1-3-5-11/h1-5H,6-10H2,(H4,17,18,20,21,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 300 nM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135664
(3-Morpholin-4-ylmethyl-pyrimido[5,4-e][1,2,4]triaz...)Show InChI InChI=1S/C10H14N8O/c11-8-7-9(15-10(12)14-8)17-16-6(13-7)5-18-1-3-19-4-2-18/h1-5H2,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
Tyrosine-protein phosphatase non-receptor type 1
(Homo sapiens (Human)) | BDBM50135666
(2-[(5,7-Diamino-pyrimido[5,4-e][1,2,4]triazin-3-yl...)Show InChI InChI=1S/C10H16N8O2/c11-8-7-9(15-10(12)14-8)17-16-6(13-7)5-18(1-3-19)2-4-20/h19-20H,1-5H2,(H4,11,12,14,15,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center
Curated by ChEMBL
| Assay Description
Inhibition of Protein-tyrosine phosphatase 1B in 2 mM DTT |
Bioorg Med Chem Lett 13: 2895-8 (2003)
BindingDB Entry DOI: 10.7270/Q21V5DDS |
More data for this
Ligand-Target Pair | |
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