BDBM139738 US8895549, 20

SMILES: COc1c(OC[C@H](O)CN(C(C)C)C(C)C)ccc2C3=NCCN3C(NC(=O)c3cccnc3C)=Nc12

InChI Key: InChIKey=RQQIKIRFUHHNNF-LJQANCHMSA-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 = 139738   

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))	BDBM139738 (US8895549, 20) Show SMILES COc1c(OC[C@H](O)CN(C(C)C)C(C)C)ccc2C3=NCCN3C(NC(=O)c3cccnc3C)=Nc12 |r,c:36,t:19| Show InChI InChI=1S/C27H36N6O4/c1-16(2)33(17(3)4)14-19(34)15-37-22-10-9-21-23(24(22)36-6)30-27(32-13-12-29-25(21)32)31-26(35)20-8-7-11-28-18(20)5/h7-11,16-17,19,34H,12-15H2,1-6H3,(H,30,31,35)/t19-/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	4.20	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