null

SMILES: Nc1ncc(cn1)-c1nc(nc2N(CCc12)[C@H]1C[C@@H](C1)C#N)N1CCOCC1

InChI Key: InChIKey=KJKSBAHDBRZXGF-MQMHXKEQSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 207082   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM207082 (US9260439, 59) Show SMILES Nc1ncc(cn1)-c1nc(nc2N(CCc12)[C@H]1C[C@@H](C1)C#N)N1CCOCC1 |r,wU:16.18,wD:18.23,(-.43,7.42,;-.43,5.88,;.9,5.11,;.9,3.57,;-.43,2.8,;-1.76,3.57,;-1.76,5.11,;-.43,1.26,;-1.76,.49,;-1.76,-1.05,;-.43,-1.82,;.9,-1.05,;2.37,-1.53,;3.27,-.28,;2.37,.96,;.9,.49,;3.14,-2.86,;4.62,-3.26,;4.23,-4.75,;2.74,-4.35,;5,-6.08,;5.77,-7.42,;-3.1,-1.82,;-4.43,-1.05,;-5.77,-1.82,;-5.77,-3.36,;-4.43,-4.13,;-3.1,-3.36,)| Show InChI InChI=1S/C19H22N8O/c20-9-12-7-14(8-12)27-2-1-15-16(13-10-22-18(21)23-11-13)24-19(25-17(15)27)26-3-5-28-6-4-26/h10-12,14H,1-8H2,(H2,21,22,23)/t12-,14-	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<0.229	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
PFIZER INC. US Patent					Assay Description PI3KA_FL: Genes encoding for full length p110alpha and p85alpha subunits of PI3Kalpha complex were subcloned from existing constructs into pFASTBAC D...				US Patent US9260439 (2016) BindingDB Entry DOI: 10.7270/Q2VH5MPV
					More data for this Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha [Q431L,Q432E,D433V,Q434L,V435F,V436Q,K437G,E438P]/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM207082 (US9260439, 59) Show SMILES Nc1ncc(cn1)-c1nc(nc2N(CCc12)[C@H]1C[C@@H](C1)C#N)N1CCOCC1 |r,wU:16.18,wD:18.23,(-.43,7.42,;-.43,5.88,;.9,5.11,;.9,3.57,;-.43,2.8,;-1.76,3.57,;-1.76,5.11,;-.43,1.26,;-1.76,.49,;-1.76,-1.05,;-.43,-1.82,;.9,-1.05,;2.37,-1.53,;3.27,-.28,;2.37,.96,;.9,.49,;3.14,-2.86,;4.62,-3.26,;4.23,-4.75,;2.74,-4.35,;5,-6.08,;5.77,-7.42,;-3.1,-1.82,;-4.43,-1.05,;-5.77,-1.82,;-5.77,-3.36,;-4.43,-4.13,;-3.1,-3.36,)| Show InChI InChI=1S/C19H22N8O/c20-9-12-7-14(8-12)27-2-1-15-16(13-10-22-18(21)23-11-13)24-19(25-17(15)27)26-3-5-28-6-4-26/h10-12,14H,1-8H2,(H2,21,22,23)/t12-,14-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.122	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
PFIZER INC. US Patent					Assay Description PI3KA_Act: Genes encoding for full length p110alpha and p85alpha nSH-iSH2=niSH2 (p85a aminoacids 322-600) subunits of PI3Kalpha complex were subclone...				US Patent US9260439 (2016) BindingDB Entry DOI: 10.7270/Q2VH5MPV
					More data for this Ligand-Target Pair