BDBM50347095 CHEMBL1796760

SMILES: CNC(=O)c1ccc(N(C)C(=O)c2cc3CCOc4cc(ccc4-c3s2)C(=O)NC)c(Cl)c1

InChI Key: InChIKey=UPTRETUIYCCQBQ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50347095   

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 alpha isoform (Homo sapiens (Human))	BDBM50347095 (CHEMBL1796760) Show SMILES CNC(=O)c1ccc(N(C)C(=O)c2cc3CCOc4cc(ccc4-c3s2)C(=O)NC)c(Cl)c1 Show InChI InChI=1S/C24H22ClN3O4S/c1-26-22(29)14-5-7-18(17(25)10-14)28(3)24(31)20-12-13-8-9-32-19-11-15(23(30)27-2)4-6-16(19)21(13)33-20/h4-7,10-12H,8-9H2,1-3H3,(H,26,29)(H,27,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. Curated by ChEMBL					Assay Description Inhibition of recombinant PI3Kalpha assessed as inhibition of PIP3 formation by fluorescence polarization assay				Bioorg Med Chem Lett 21: 4054-8 (2011) Article DOI: 10.1016/j.bmcl.2011.04.124 BindingDB Entry DOI: 10.7270/Q29G5N57
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