BDBM50356930 CHEMBL1914475

SMILES: CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1

InChI Key: InChIKey=CCECKHDWHUIQQG-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50356930   

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))	BDBM50356930 (CHEMBL1914475) Show SMILES CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1 |w:9.8,c:13| Show InChI InChI=1S/C13H10N4O3S/c1-7(18)14-10-6-17-5-8(2-3-11(17)15-10)4-9-12(19)16-13(20)21-9/h2-6H,1H3,(H,14,18)(H,16,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha by HTRF assay				Bioorg Med Chem Lett 21: 6586-90 (2011) Article DOI: 10.1016/j.bmcl.2011.07.117 BindingDB Entry DOI: 10.7270/Q2GF0TW1
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM50356930 (CHEMBL1914475) Show SMILES CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1 |w:9.8,c:13| Show InChI InChI=1S/C13H10N4O3S/c1-7(18)14-10-6-17-5-8(2-3-11(17)15-10)4-9-12(19)16-13(20)21-9/h2-6H,1H3,(H,14,18)(H,16,19,20)	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	34	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of recombinant human PI3Kgamma by HTRF assay				Bioorg Med Chem Lett 21: 6586-90 (2011) Article DOI: 10.1016/j.bmcl.2011.07.117 BindingDB Entry DOI: 10.7270/Q2GF0TW1
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM50356930 (CHEMBL1914475) Show SMILES CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1 |w:9.8,c:13| Show InChI InChI=1S/C13H10N4O3S/c1-7(18)14-10-6-17-5-8(2-3-11(17)15-10)4-9-12(19)16-13(20)21-9/h2-6H,1H3,(H,14,18)(H,16,19,20)	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	760	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of PI3Kgamma in human neutrophils assessed as inhibition of fMLP-stimulated superoxide production				Bioorg Med Chem Lett 21: 6586-90 (2011) Article DOI: 10.1016/j.bmcl.2011.07.117 BindingDB Entry DOI: 10.7270/Q2GF0TW1
					More data for this Ligand-Target Pair