Found 9 hits Enz. Inhib. hit(s) with Target = 'Phenylethanolamine N-methyltransferase' and Ligand = 'BDBM14061' 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 |
Phenylethanolamine N-methyltransferase
(Homo sapiens (Human)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| DrugBank MMDB PDB Article PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan
Curated by ChEMBL
| Assay Description Inhibitory binding affinity for phenylethanolamine N-methyltransferase (PNMT) |
Bioorg Med Chem Lett 14: 4217-20 (2004)
Article DOI: 10.1016/j.bmcl.2004.06.009 BindingDB Entry DOI: 10.7270/Q2R49Q6M |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Bos taurus (bovine)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB
UniProtKB/SwissProt
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| PDB PubMed
| 220 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by ChEMBL
| Assay Description Inhibitory constant against bovine phenylethanolamine N-methyl-transferase |
Bioorg Med Chem Lett 11: 1579-82 (2001)
BindingDB Entry DOI: 10.7270/Q2GF0V17 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Bos taurus (bovine)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB
UniProtKB/SwissProt
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Patents
| PDB Article PubMed
| 260 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by ChEMBL
| Assay Description Inhibition of PNMT (Phenylethanolamine N-Methyltransferase) in vitro |
J Med Chem 42: 3315-23 (1999)
Article DOI: 10.1021/jm980734a BindingDB Entry DOI: 10.7270/Q2513XD6 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Bos taurus (bovine)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB
UniProtKB/SwissProt
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Patents
| PDB Article PubMed
| 260 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by ChEMBL
| Assay Description Affinity for bovine Phenylethanolamine N-Methyltransferase (PNMT) |
J Med Chem 42: 3588-601 (1999)
Article DOI: 10.1021/jm990045e BindingDB Entry DOI: 10.7270/Q2NV9HFK |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Bos taurus (bovine)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
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CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Patents
| PDB PubMed
| 260 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by ChEMBL
| Assay Description Ability to inhibit phenylethanolamine N-methyltransferase (PNMT) |
J Med Chem 44: 2849-56 (2001)
BindingDB Entry DOI: 10.7270/Q2N58KNT |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Bos taurus (bovine)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB
UniProtKB/SwissProt
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| 260 | -39.1 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
University of Queensland
| Assay Description Enzyme activity is determined by measuring the amount of 3H incorporated into the substrate during the reaction. AdoMet/[methyl-3H]AdoMet serves as a... |
J Med Chem 47: 37-44 (2004)
Article DOI: 10.1021/jm0205752 BindingDB Entry DOI: 10.7270/Q21R6NRH |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Homo sapiens (Human)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Patents
| DrugBank MMDB PDB PubMed
| 280 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by ChEMBL
| Assay Description Inhibitory constant against human phenylethanolamine N-methyl-transferase over-expressed in Escherichia coli |
Bioorg Med Chem Lett 11: 1579-82 (2001)
BindingDB Entry DOI: 10.7270/Q2GF0V17 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Bos taurus (bovine)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB
UniProtKB/SwissProt
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| 1.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by ChEMBL
| Assay Description Inhibitory activity against bovine adrenal phenylethanolamine N-methyl-transferase (PNMT) |
Bioorg Med Chem Lett 9: 481-6 (1999)
BindingDB Entry DOI: 10.7270/Q26Q20F9 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phenylethanolamine N-methyltransferase
(Homo sapiens (Human)) | BDBM14061
(8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine |...)Show InChI InChI=1S/C10H11Cl2N/c11-9-4-3-7-2-1-5-13-6-8(7)10(9)12/h3-4,13H,1-2,5-6H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Patents
| DrugBank MMDB PDB Article PubMed
| 4.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan
Curated by ChEMBL
| Assay Description Binding affinity to human wild type his-tagged PNMT |
J Med Chem 48: 7243-52 (2005)
Article DOI: 10.1021/jm050568o BindingDB Entry DOI: 10.7270/Q2QC049M |
More data for this Ligand-Target Pair | 3D Structure (crystal) |