BDBM207095 US9260439, 72

SMILES: Nc1ncc(cn1)-c1nc(nc2N(CCc12)C1CN(C1)S(N)(=O)=O)N1CCOCC1

InChI Key: InChIKey=BAAPPMUCJSGTLU-UHFFFAOYSA-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 = 207095   

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))	BDBM207095 (US9260439, 72) Show SMILES Nc1ncc(cn1)-c1nc(nc2N(CCc12)C1CN(C1)S(N)(=O)=O)N1CCOCC1 Show InChI InChI=1S/C17H23N9O3S/c18-16-20-7-11(8-21-16)14-13-1-2-26(12-9-25(10-12)30(19,27)28)15(13)23-17(22-14)24-3-5-29-6-4-24/h7-8,12H,1-6,9-10H2,(H2,18,20,21)(H2,19,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.129	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))	BDBM207095 (US9260439, 72) Show SMILES Nc1ncc(cn1)-c1nc(nc2N(CCc12)C1CN(C1)S(N)(=O)=O)N1CCOCC1 Show InChI InChI=1S/C17H23N9O3S/c18-16-20-7-11(8-21-16)14-13-1-2-26(12-9-25(10-12)30(19,27)28)15(13)23-17(22-14)24-3-5-29-6-4-24/h7-8,12H,1-6,9-10H2,(H2,18,20,21)(H2,19,27,28)	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