BDBM207080 US9260439, 57

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

InChI Key: InChIKey=PHNZGGYGZYAKRE-GASCZTMLSA-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 = 207080   

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
p110α/p85α (Homo sapiens (Human))	BDBM207080 (US9260439, 57) Show SMILES CNS(=O)(=O)N(C)[C@H]1C[C@H](C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r,wU:9.11,7.6,(5.44,-8.5,;4.35,-7.41,;4.75,-5.92,;6.23,-6.32,;5.15,-4.44,;3.26,-5.52,;2.17,-6.61,;2.86,-4.04,;1.53,-3.27,;2.3,-1.93,;3.63,-2.7,;1.9,-.45,;2.8,.8,;1.9,2.05,;.43,1.57,;.43,.03,;-.9,-.74,;-2.23,.03,;-2.23,1.57,;-.9,2.34,;-.9,3.88,;.43,4.65,;.43,6.19,;-.9,6.96,;-.9,8.5,;-2.23,6.19,;-2.23,4.65,;-3.57,-.74,;-4.9,.03,;-6.23,-.74,;-6.23,-2.28,;-4.9,-3.05,;-3.57,-2.28,)| Show InChI InChI=1S/C20H29N9O3S/c1-22-33(30,31)27(2)14-9-15(10-14)29-4-3-16-17(13-11-23-19(21)24-12-13)25-20(26-18(16)29)28-5-7-32-8-6-28/h11-12,14-15,22H,3-10H2,1-2H3,(H2,21,23,24)/t14-,15+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.318	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
p110alpha-iSH2 p85alpha Complex (Homo sapiens (Human))	BDBM207080 (US9260439, 57) Show SMILES CNS(=O)(=O)N(C)[C@H]1C[C@H](C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r,wU:9.11,7.6,(5.44,-8.5,;4.35,-7.41,;4.75,-5.92,;6.23,-6.32,;5.15,-4.44,;3.26,-5.52,;2.17,-6.61,;2.86,-4.04,;1.53,-3.27,;2.3,-1.93,;3.63,-2.7,;1.9,-.45,;2.8,.8,;1.9,2.05,;.43,1.57,;.43,.03,;-.9,-.74,;-2.23,.03,;-2.23,1.57,;-.9,2.34,;-.9,3.88,;.43,4.65,;.43,6.19,;-.9,6.96,;-.9,8.5,;-2.23,6.19,;-2.23,4.65,;-3.57,-.74,;-4.9,.03,;-6.23,-.74,;-6.23,-2.28,;-4.9,-3.05,;-3.57,-2.28,)| Show InChI InChI=1S/C20H29N9O3S/c1-22-33(30,31)27(2)14-9-15(10-14)29-4-3-16-17(13-11-23-19(21)24-12-13)25-20(26-18(16)29)28-5-7-32-8-6-28/h11-12,14-15,22H,3-10H2,1-2H3,(H2,21,23,24)/t14-,15+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.465	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