Found 2 hits Enz. Inhib. hit(s) with Target = 'Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform' and Ligand = 'BDBM50004534' 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 |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50004534
(CHEMBL2216898)Show SMILES CC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(OC2CCN(C)CC2)n1 Show InChI InChI=1S/C23H27N7O/c1-14-5-4-6-16-11-18(15(2)28-22-20-21(25-12-24-20)26-13-27-22)29-23(19(14)16)31-17-7-9-30(3)10-8-17/h4-6,11-13,15,17H,7-10H2,1-3H3,(H2,24,25,26,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of PI3Kdelta |
J Med Chem 55: 8559-81 (2012)
Article DOI: 10.1021/jm300847w BindingDB Entry DOI: 10.7270/Q2SN0B47 |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50004534
(CHEMBL2216898)Show SMILES CC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(OC2CCN(C)CC2)n1 Show InChI InChI=1S/C23H27N7O/c1-14-5-4-6-16-11-18(15(2)28-22-20-21(25-12-24-20)26-13-27-22)29-23(19(14)16)31-17-7-9-30(3)10-8-17/h4-6,11-13,15,17H,7-10H2,1-3H3,(H2,24,25,26,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of PI3Kdelta in B-cells by proliferation assay |
J Med Chem 55: 8559-81 (2012)
Article DOI: 10.1021/jm300847w BindingDB Entry DOI: 10.7270/Q2SN0B47 |
More data for this Ligand-Target Pair | |