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SMILES: Nc1ncnn2c(cc(-c3ccnn3C3CCOCC3)c12)-c1cccc(c1)[C@@H]1C[C@@H](O)CN1C(=O)C1CC1

InChI Key: InChIKey=HQNVTLVVGHHAOG-QPPBQGQZSA-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 = 358072   
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))		BDBM358072
PNG
(((2S,4R)-2-(3-(4-Amino-5-(1-(tetrahydro-2H-pyran-4...)
Show SMILES Nc1ncnn2c(cc(-c3ccnn3C3CCOCC3)c12)-c1cccc(c1)[C@@H]1C[C@@H](O)CN1C(=O)C1CC1 |r|
Show InChI InChI=1S/C28H31N7O3/c29-27-26-22(23-6-9-31-34(23)20-7-10-38-11-8-20)14-25(35(26)32-16-30-27)19-3-1-2-18(12-19)24-13-21(36)15-33(24)28(37)17-4-5-17/h1-3,6,9,12,14,16-17,20-21,24,36H,4-5,7-8,10-11,13,15H2,(H2,29,30,32)/t21-,24+/m1/s1
PDB
MMDB

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PC cid
PC sid
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US Patent
n/an/a 0.5n/an/an/an/an/an/a



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 US10214537 (2019)


BindingDB Entry DOI: 10.7270/Q2HH6NB2
More data for this
Ligand-Target Pair