BDBM207127 US9260439, 104

SMILES: CNS(=O)(=O)O[C@H]1C[C@H](C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1

InChI Key: InChIKey=AQNAGNRCGWKSSJ-OKILXGFUSA-N

Data: 2 KI

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 = 207127   

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
p110alpha-iSH2 p85alpha Complex (Homo sapiens (Human))	BDBM207127 (US9260439, 104) Show SMILES CNS(=O)(=O)O[C@H]1C[C@H](C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r,wD:8.10,6.5,(6.07,-6.82,;4.73,-7.59,;3.4,-6.82,;4.17,-5.49,;2.63,-8.15,;2.07,-6.05,;2.07,-4.51,;3.15,-3.42,;2.07,-2.33,;.98,-3.42,;2.07,-.79,;2.97,.45,;2.07,1.7,;.6,1.22,;.6,-.32,;-.73,-1.09,;-2.07,-.32,;-2.07,1.22,;-.73,1.99,;-.73,3.53,;.6,4.3,;.6,5.84,;-.73,6.61,;-.73,8.15,;-2.07,5.84,;-2.07,4.3,;-3.4,-1.09,;-4.73,-.32,;-6.07,-1.09,;-6.07,-2.63,;-4.73,-3.4,;-3.4,-2.63,)| Show InChI InChI=1S/C19H26N8O4S/c1-21-32(28,29)31-14-8-13(9-14)27-3-2-15-16(12-10-22-18(20)23-11-12)24-19(25-17(15)27)26-4-6-30-7-5-26/h10-11,13-14,21H,2-9H2,1H3,(H2,20,22,23)/t13-,14+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.0790	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
p110α/p85α (Homo sapiens (Human))	BDBM207127 (US9260439, 104) Show SMILES CNS(=O)(=O)O[C@H]1C[C@H](C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r,wD:8.10,6.5,(6.07,-6.82,;4.73,-7.59,;3.4,-6.82,;4.17,-5.49,;2.63,-8.15,;2.07,-6.05,;2.07,-4.51,;3.15,-3.42,;2.07,-2.33,;.98,-3.42,;2.07,-.79,;2.97,.45,;2.07,1.7,;.6,1.22,;.6,-.32,;-.73,-1.09,;-2.07,-.32,;-2.07,1.22,;-.73,1.99,;-.73,3.53,;.6,4.3,;.6,5.84,;-.73,6.61,;-.73,8.15,;-2.07,5.84,;-2.07,4.3,;-3.4,-1.09,;-4.73,-.32,;-6.07,-1.09,;-6.07,-2.63,;-4.73,-3.4,;-3.4,-2.63,)| Show InChI InChI=1S/C19H26N8O4S/c1-21-32(28,29)31-14-8-13(9-14)27-3-2-15-16(12-10-22-18(20)23-11-12)24-19(25-17(15)27)26-4-6-30-7-5-26/h10-11,13-14,21H,2-9H2,1H3,(H2,20,22,23)/t13-,14+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL 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