Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform' and Ligand = 'BDBM139727'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM139727 (US8895549, 5) Show SMILES COc1c(OC[C@H](O)CN2CC3CCC(C2)O3)ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc12 |r,c:38,t:22| Show InChI InChI=1S/C26H30N6O5/c1-35-23-21(36-15-17(33)12-31-13-18-4-5-19(14-31)37-18)7-6-20-22(23)29-26(32-10-9-28-24(20)32)30-25(34)16-3-2-8-27-11-16/h2-3,6-8,11,17-19,33H,4-5,9-10,12-15H2,1H3,(H,29,30,34)/t17-,18?,19?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.68	n/a	n/a	n/a	n/a	n/a	n/a
Bayer Intellectual Property GmbH US Patent					Assay Description As reagents for the kinase reaction itself and the quantification of the reaction product, the PI3-Kinase HTRF Assay kit from Millipore (#33-017) was...				US Patent US8895549 (2014) BindingDB Entry DOI: 10.7270/Q2NC5ZWF
					More data for this Ligand-Target Pair