Found 4 hits for monomerid = 50138382 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 beta
(Homo sapiens (Human)) | BDBM50138382
(5-(4-{4-[4-(Piperazine-1-sulfonyl)-phenyl]-pyrimid...)Show SMILES NC(=O)c1c[nH]c2ccc(cc12)-c1ccc(Nc2nccc(n2)-c2ccc(cc2)S(=O)(=O)N2CCNCC2)cc1 Show InChI InChI=1S/C29H27N7O3S/c30-28(37)25-18-33-27-10-5-21(17-24(25)27)19-1-6-22(7-2-19)34-29-32-12-11-26(35-29)20-3-8-23(9-4-20)40(38,39)36-15-13-31-14-16-36/h1-12,17-18,31,33H,13-16H2,(H2,30,37)(H,32,34,35) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 550 | 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 | |
Inhibitor of nuclear factor kappa-B kinase subunit alpha
(Homo sapiens (Human)) | BDBM50138382
(5-(4-{4-[4-(Piperazine-1-sulfonyl)-phenyl]-pyrimid...)Show SMILES NC(=O)c1c[nH]c2ccc(cc12)-c1ccc(Nc2nccc(n2)-c2ccc(cc2)S(=O)(=O)N2CCNCC2)cc1 Show InChI InChI=1S/C29H27N7O3S/c30-28(37)25-18-33-27-10-5-21(17-24(25)27)19-1-6-22(7-2-19)34-29-32-12-11-26(35-29)20-3-8-23(9-4-20)40(38,39)36-15-13-31-14-16-36/h1-12,17-18,31,33H,13-16H2,(H2,30,37)(H,32,34,35) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 3.09E+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)) | BDBM50138382
(5-(4-{4-[4-(Piperazine-1-sulfonyl)-phenyl]-pyrimid...)Show SMILES NC(=O)c1c[nH]c2ccc(cc12)-c1ccc(Nc2nccc(n2)-c2ccc(cc2)S(=O)(=O)N2CCNCC2)cc1 Show InChI InChI=1S/C29H27N7O3S/c30-28(37)25-18-33-27-10-5-21(17-24(25)27)19-1-6-22(7-2-19)34-29-32-12-11-26(35-29)20-3-8-23(9-4-20)40(38,39)36-15-13-31-14-16-36/h1-12,17-18,31,33H,13-16H2,(H2,30,37)(H,32,34,35) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 550 | 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 | |
Inhibitor of nuclear factor kappa-B kinase subunit alpha
(Homo sapiens (Human)) | BDBM50138382
(5-(4-{4-[4-(Piperazine-1-sulfonyl)-phenyl]-pyrimid...)Show SMILES NC(=O)c1c[nH]c2ccc(cc12)-c1ccc(Nc2nccc(n2)-c2ccc(cc2)S(=O)(=O)N2CCNCC2)cc1 Show InChI InChI=1S/C29H27N7O3S/c30-28(37)25-18-33-27-10-5-21(17-24(25)27)19-1-6-22(7-2-19)34-29-32-12-11-26(35-29)20-3-8-23(9-4-20)40(38,39)36-15-13-31-14-16-36/h1-12,17-18,31,33H,13-16H2,(H2,30,37)(H,32,34,35) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 3.09E+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 | |
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