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 = 'BDBM139740'   

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))	BDBM139740 (US8895549, 41) Show SMILES COc1c(OC[C@H](O)CN(C(C)C)C(C)C)ccc2C3=NCCN3C(NC(=O)c3cncs3)=Nc12 |r,c:34,t:19| Show InChI InChI=1S/C24H32N6O4S/c1-14(2)30(15(3)4)11-16(31)12-34-18-7-6-17-20(21(18)33-5)27-24(29-9-8-26-22(17)29)28-23(32)19-10-25-13-35-19/h6-7,10,13-16,31H,8-9,11-12H2,1-5H3,(H,27,28,32)/t16-/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	5.83	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
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