BDBM139736 US8895549, 11

SMILES: COc1c(OC[C@H](O)CN(C)C)ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc12

InChI Key: InChIKey=ZVUFDJMMHRDAHB-OAHLLOKOSA-N

Data: 1 IC50

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 1 hit for monomerid = 139736   

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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM139736 (US8895549, 11) Show SMILES COc1c(OC[C@H](O)CN(C)C)ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc12 |r,c:31,t:15| Show InChI InChI=1S/C22H26N6O4/c1-27(2)12-15(29)13-32-17-7-6-16-18(19(17)31-3)25-22(28-10-9-24-20(16)28)26-21(30)14-5-4-8-23-11-14/h4-8,11,15,29H,9-10,12-13H2,1-3H3,(H,25,26,30)/t15-/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	1.60	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