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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 284871   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM284871
PNG
(7-(2-(piperazin-1-yl)pyridin-4-yl)-5- (1-(tetrahyd...)
Show SMILES Nc1ncnn2c(cc(-c3ccnn3C3CCOCC3)c12)-c1ccnc(c1)N1CCNCC1
Show InChI InChI=1S/C23H27N9O/c24-23-22-18(19-2-6-28-31(19)17-3-11-33-12-4-17)14-20(32(22)29-15-27-23)16-1-5-26-21(13-16)30-9-7-25-8-10-30/h1-2,5-6,13-15,17,25H,3-4,7-12H2,(H2,24,27,29)
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.80n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta (unknown origin) using PIP2:PS as substrate incubated for 3 hrs by ADP-Glo assay


Bioorg Med Chem Lett 27: 855-861 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.016
BindingDB Entry DOI: 10.7270/Q2BR8VFH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM284871
PNG
(7-(2-(piperazin-1-yl)pyridin-4-yl)-5- (1-(tetrahyd...)
Show SMILES Nc1ncnn2c(cc(-c3ccnn3C3CCOCC3)c12)-c1ccnc(c1)N1CCNCC1
Show InChI InChI=1S/C23H27N9O/c24-23-22-18(19-2-6-28-31(19)17-3-11-33-12-4-17)14-20(32(22)29-15-27-23)16-1-5-26-21(13-16)30-9-7-25-8-10-30/h1-2,5-6,13-15,17,25H,3-4,7-12H2,(H2,24,27,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2n/an/an/an/a7.525



Bristol-Myers Squibb Company

US Patent


Assay Description
The ADP-Glo format PI3K assays were performed in Proxiplate 384-well plates (Perkin Elmer #6008280). The final assay volume was 2 μl prepared fr...


US Patent US10023576 (2018)


BindingDB Entry DOI: 10.7270/Q2FQ9ZND
More data for this
Ligand-Target Pair