BDBM50004561 CHEMBL2216875

SMILES: CC(=O)Nc1nc2ccc(cc2s1)-c1nn(C2CCCC2)c2ncnc(N)c12

InChI Key: InChIKey=VLJBDXXWPQCWCH-UHFFFAOYSA-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 = 50004561   

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 delta isoform (Homo sapiens (Human))	BDBM50004561 (CHEMBL2216875) Show SMILES CC(=O)Nc1nc2ccc(cc2s1)-c1nn(C2CCCC2)c2ncnc(N)c12 Show InChI InChI=1S/C19H19N7OS/c1-10(27)23-19-24-13-7-6-11(8-14(13)28-19)16-15-17(20)21-9-22-18(15)26(25-16)12-4-2-3-5-12/h6-9,12H,2-5H2,1H3,(H2,20,21,22)(H,23,24,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of PI3Kdelta				J Med Chem 55: 8559-81 (2012) Article DOI: 10.1021/jm300847w BindingDB Entry DOI: 10.7270/Q2SN0B47
					More data for this Ligand-Target Pair