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SMILES: CC[C@H](Nc1ncnc(N)c1-c1ccon1)c1nc2cccc(Cl)c2c(=O)n1C1CC1

InChI Key: InChIKey=HRAOPBOFBQTNTF-ZDUSSCGKSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 188332   
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 beta/delta isoform


(Homo sapiens (Human))		BDBM188332
PNG
(US9670194, Ex. 14 (S)-2-(1-((6-amino-5-(isoxazol-3...)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1ccon1)c1nc2cccc(Cl)c2c(=O)n1C1CC1 |r|
Show InChI InChI=1S/C21H20ClN7O2/c1-2-13(26-19-17(15-8-9-31-28-15)18(23)24-10-25-19)20-27-14-5-3-4-12(22)16(14)21(30)29(20)11-6-7-11/h3-5,8-11,13H,2,6-7H2,1H3,(H3,23,24,25,26)/t13-/m0/s1
PDB

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PC cid
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UniChem
US Patent
n/an/a 20n/an/an/an/an/a25



CALITOR SCIENCES, LLC; SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
PI3K (p110α/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol 4,5-bisphosphate and MgATP (concentration as ...

US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair