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SMILES: C[C@H](Nc1ncnc(N)c1-c1cncc(c1)C(F)(F)F)c1nn2ccc(C)c2c(=O)n1-c1ccccc1

InChI Key: InChIKey=VUDLLAVHOYQMQU-HNNXBMFYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 236957   
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 delta isoform


(Homo sapiens (Human))
BDBM236957
PNG
(US9388189, 114)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1cncc(c1)C(F)(F)F)c1nn2ccc(C)c2c(=O)n1-c1ccccc1
Show InChI InChI=1S/C25H21F3N8O/c1-14-8-9-35-20(14)24(37)36(18-6-4-3-5-7-18)23(34-35)15(2)33-22-19(21(29)31-13-32-22)16-10-17(12-30-11-16)25(26,27)28/h3-13,15H,1-2H3,(H3,29,31,32,33)/t15-/m0/s1
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 0.5n/an/an/an/an/an/a



Almirall, S.A.

US Patent


Assay Description
PI-3 Kinase HTRF kit (ref. #33-037) and the different PI3K recombinant isoforms (ref. #14-602, ref. #14-603, ref. #14-604, ref. #15-558 for Alpha, Be...


US Patent US9388189 (2016)


BindingDB Entry DOI: 10.7270/Q2K64H0P
More data for this
Ligand-Target Pair