BDBM207102 US9260439, 79

SMILES: C[C@H]1COCCN1c1nc2N(CCc2c(n1)-c1cnc(N)nc1)[C@H]1CCN(C1)S(C)(=O)=O

InChI Key: InChIKey=BAYPUQLIAYEWSL-ZFWWWQNUSA-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 = 207102   

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))	BDBM207102 (US9260439, 79) Show SMILES C[C@H]1COCCN1c1nc2N(CCc2c(n1)-c1cnc(N)nc1)[C@H]1CCN(C1)S(C)(=O)=O |r| Show InChI InChI=1S/C20H28N8O3S/c1-13-12-31-8-7-27(13)20-24-17(14-9-22-19(21)23-10-14)16-4-6-28(18(16)25-20)15-3-5-26(11-15)32(2,29)30/h9-10,13,15H,3-8,11-12H2,1-2H3,(H2,21,22,23)/t13-,15-/m0/s1	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
p110alpha-iSH2 p85alpha Complex (Homo sapiens (Human))	BDBM207102 (US9260439, 79) Show SMILES C[C@H]1COCCN1c1nc2N(CCc2c(n1)-c1cnc(N)nc1)[C@H]1CCN(C1)S(C)(=O)=O |r| Show InChI InChI=1S/C20H28N8O3S/c1-13-12-31-8-7-27(13)20-24-17(14-9-22-19(21)23-10-14)16-4-6-28(18(16)25-20)15-3-5-26(11-15)32(2,29)30/h9-10,13,15H,3-8,11-12H2,1-2H3,(H2,21,22,23)/t13-,15-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.257	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