BDBM50387530 CHEMBL2059910

SMILES: CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C

InChI Key: InChIKey=MMOOFFFQYJLTLQ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50387530   

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 gamma isoform (Homo sapiens (Human))	BDBM50387530 (CHEMBL2059910) Show SMILES CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C Show InChI InChI=1S/C17H21N7O3S/c1-17(2,3)23-28(26,27)13-7-12(8-19-9-13)11-5-6-14-20-15(21-16(25)18-4)22-24(14)10-11/h5-10,23H,1-4H3,(H2,18,21,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12.6	n/a	n/a	n/a	n/a	n/a	n/a
Cellzome Ltd Curated by ChEMBL					Assay Description Inhibition of PI3Kgamma in human HL60 cell lysate by kinobead assay				Bioorg Med Chem Lett 22: 4546-9 (2012) Article DOI: 10.1016/j.bmcl.2012.05.121 BindingDB Entry DOI: 10.7270/Q2J38TMN
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50387530 (CHEMBL2059910) Show SMILES CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C Show InChI InChI=1S/C17H21N7O3S/c1-17(2,3)23-28(26,27)13-7-12(8-19-9-13)11-5-6-14-20-15(21-16(25)18-4)22-24(14)10-11/h5-10,23H,1-4H3,(H2,18,21,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	398	n/a	n/a	n/a	n/a	n/a	n/a
Cellzome Ltd Curated by ChEMBL					Assay Description Inhibition of PI3Kbeta in human HL60 cell lysate by kinobead assay				Bioorg Med Chem Lett 22: 4546-9 (2012) Article DOI: 10.1016/j.bmcl.2012.05.121 BindingDB Entry DOI: 10.7270/Q2J38TMN
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50387530 (CHEMBL2059910) Show SMILES CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C Show InChI InChI=1S/C17H21N7O3S/c1-17(2,3)23-28(26,27)13-7-12(8-19-9-13)11-5-6-14-20-15(21-16(25)18-4)22-24(14)10-11/h5-10,23H,1-4H3,(H2,18,21,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
Cellzome Ltd Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha in human HL60 cell lysate by kinobead assay				Bioorg Med Chem Lett 22: 4546-9 (2012) Article DOI: 10.1016/j.bmcl.2012.05.121 BindingDB Entry DOI: 10.7270/Q2J38TMN
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50387530 (CHEMBL2059910) Show SMILES CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C Show InChI InChI=1S/C17H21N7O3S/c1-17(2,3)23-28(26,27)13-7-12(8-19-9-13)11-5-6-14-20-15(21-16(25)18-4)22-24(14)10-11/h5-10,23H,1-4H3,(H2,18,21,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	794	n/a	n/a	n/a	n/a	n/a	n/a
Cellzome Ltd Curated by ChEMBL					Assay Description Inhibition of PI3Kdelta in human HL60 cell lysate by kinobead assay				Bioorg Med Chem Lett 22: 4546-9 (2012) Article DOI: 10.1016/j.bmcl.2012.05.121 BindingDB Entry DOI: 10.7270/Q2J38TMN
					More data for this Ligand-Target Pair