Found 2 hits for monomerid = 50341990 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Protein-tyrosine phosphatase 1B
(Homo sapiens (Human)) | BDBM50341990
![PNG](/data/jpeg/tenK5034/BindingDB_50341990.png) ((S)-2-[2-(4-Methoxy-phenyl)-acetylamino]-N-{(S)-1-...)Show SMILES CCCCCNC(=O)[C@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1 |r| Show InChI InChI=1S/C35H42N4O7S/c1-3-4-8-19-36-34(42)29(21-25-11-15-27(16-12-25)31-23-33(41)39-47(31,44)45)38-35(43)30(20-24-9-6-5-7-10-24)37-32(40)22-26-13-17-28(46-2)18-14-26/h5-7,9-18,29-31H,3-4,8,19-23H2,1-2H3,(H,36,42)(H,37,40)(H,38,43)(H,39,41)/t29-,30-,31-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of Homo sapiens (human) PTP1B expressed in Escherichia coli using PNPP as substrate |
Citation and Details
Article DOI: 10.1007/s00044-012-0349-7 BindingDB Entry DOI: 10.7270/Q2KH0R8R |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (docked) |
Protein-tyrosine phosphatase 1B
(Homo sapiens (Human)) | BDBM50341990
![PNG](/data/jpeg/tenK5034/BindingDB_50341990.png) ((S)-2-[2-(4-Methoxy-phenyl)-acetylamino]-N-{(S)-1-...)Show SMILES CCCCCNC(=O)[C@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1 |r| Show InChI InChI=1S/C35H42N4O7S/c1-3-4-8-19-36-34(42)29(21-25-11-15-27(16-12-25)31-23-33(41)39-47(31,44)45)38-35(43)30(20-24-9-6-5-7-10-24)37-32(40)22-26-13-17-28(46-2)18-14-26/h5-7,9-18,29-31H,3-4,8,19-23H2,1-2H3,(H,36,42)(H,37,40)(H,38,43)(H,39,41)/t29-,30-,31-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Max-Planck-Institute of Molecular Physiology
Curated by ChEMBL
| Assay Description Inhibition of PTP1B |
Bioorg Med Chem 19: 2145-55 (2011)
Article DOI: 10.1016/j.bmc.2011.02.047 BindingDB Entry DOI: 10.7270/Q2BR8SHK |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (docked) |