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BDBM348142 US9790228, Compound 61

SMILES: Nc1ncnc2n(Cc3cnc4ccccc4c3)nc(-c3cc(O)cc(F)c3)c12

InChI Key: InChIKey=KDACVAQFKYXPBC-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 348142   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM348142
PNG
(US9790228, Compound 61)
Show SMILES Nc1ncnc2n(Cc3cnc4ccccc4c3)nc(-c3cc(O)cc(F)c3)c12
Show InChI InChI=1S/C21H15FN6O/c22-15-6-14(7-16(29)8-15)19-18-20(23)25-11-26-21(18)28(27-19)10-12-5-13-3-1-2-4-17(13)24-9-12/h1-9,11,29H,10H2,(H2,23,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Intellikine LLC

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9790228 (2017)


BindingDB Entry DOI: 10.7270/Q26112FV
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM348142
PNG
(US9790228, Compound 61)
Show SMILES Nc1ncnc2n(Cc3cnc4ccccc4c3)nc(-c3cc(O)cc(F)c3)c12
Show InChI InChI=1S/C21H15FN6O/c22-15-6-14(7-16(29)8-15)19-18-20(23)25-11-26-21(18)28(27-19)10-12-5-13-3-1-2-4-17(13)24-9-12/h1-9,11,29H,10H2,(H2,23,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Intellikine LLC

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9790228 (2017)


BindingDB Entry DOI: 10.7270/Q26112FV
More data for this
Ligand-Target Pair