Found 3 hits for monomerid = 50138381 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 |
Inhibitor of nuclear factor kappa-B kinase subunit alpha
(Homo sapiens (Human)) | BDBM50138381
((4-Methanesulfonyl-phenyl)-{4-[4-(piperazine-1-sul...)Show SMILES CS(=O)(=O)c1ccc(Nc2nccc(n2)-c2ccc(cc2)S(=O)(=O)N2CCNCC2)cc1 Show InChI InChI=1S/C21H23N5O4S2/c1-31(27,28)18-8-4-17(5-9-18)24-21-23-11-10-20(25-21)16-2-6-19(7-3-16)32(29,30)26-14-12-22-13-15-26/h2-11,22H,12-15H2,1H3,(H,23,24,25) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Celltech R&D Ltd
Curated by ChEMBL
| Assay Description Inhibitory activity against IKK1 |
Bioorg Med Chem Lett 14: 409-12 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ036V |
More data for this Ligand-Target Pair | |
Inhibitor of nuclear factor kappa-B kinase subunit beta
(Homo sapiens (Human)) | BDBM50138381
((4-Methanesulfonyl-phenyl)-{4-[4-(piperazine-1-sul...)Show SMILES CS(=O)(=O)c1ccc(Nc2nccc(n2)-c2ccc(cc2)S(=O)(=O)N2CCNCC2)cc1 Show InChI InChI=1S/C21H23N5O4S2/c1-31(27,28)18-8-4-17(5-9-18)24-21-23-11-10-20(25-21)16-2-6-19(7-3-16)32(29,30)26-14-12-22-13-15-26/h2-11,22H,12-15H2,1H3,(H,23,24,25) | PDB
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 | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description Inhibition of human IKKbeta using GST-IkappaBalpha as substrate |
Eur J Med Chem 63: 269-78 (2013)
Article DOI: 10.1016/j.ejmech.2013.01.045 BindingDB Entry DOI: 10.7270/Q2XG9SHG |
More data for this Ligand-Target Pair | |
Inhibitor of nuclear factor kappa-B kinase subunit beta
(Homo sapiens (Human)) | BDBM50138381
((4-Methanesulfonyl-phenyl)-{4-[4-(piperazine-1-sul...)Show SMILES CS(=O)(=O)c1ccc(Nc2nccc(n2)-c2ccc(cc2)S(=O)(=O)N2CCNCC2)cc1 Show InChI InChI=1S/C21H23N5O4S2/c1-31(27,28)18-8-4-17(5-9-18)24-21-23-11-10-20(25-21)16-2-6-19(7-3-16)32(29,30)26-14-12-22-13-15-26/h2-11,22H,12-15H2,1H3,(H,23,24,25) | PDB
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 | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Celltech R&D Ltd
Curated by ChEMBL
| Assay Description Inhibitory activity against IKK2 |
Bioorg Med Chem Lett 14: 409-12 (2003)
BindingDB Entry DOI: 10.7270/Q2WQ036V |
More data for this Ligand-Target Pair | |