null

SMILES: COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1

InChI Key: InChIKey=RGNZNWVPZKJPFW-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50460042   

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))	BDBM50460042 (CHEMBL4228946) Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1 Show InChI InChI=1S/C21H17F2N5O4S2/c1-10-14-8-17(33-20(14)27-21(25-10)26-11(2)29)12-6-16(19(32-3)24-9-12)28-34(30,31)18-5-4-13(22)7-15(18)23/h4-9,28H,1-3H3,(H,25,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences and Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of PI3Kgamma (unknown origin) using PIP2 as substrate measured after 1 hr by Kinase-Glo luminescence assay				Bioorg Med Chem 26: 637-646 (2018) Article DOI: 10.1016/j.bmc.2017.12.025 BindingDB Entry DOI: 10.7270/Q2JD50FF
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50460042 (CHEMBL4228946) Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1 Show InChI InChI=1S/C21H17F2N5O4S2/c1-10-14-8-17(33-20(14)27-21(25-10)26-11(2)29)12-6-16(19(32-3)24-9-12)28-34(30,31)18-5-4-13(22)7-15(18)23/h4-9,28H,1-3H3,(H,25,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences and Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged PI3Kalpha expressed in baculovirus expression system using PIP2 as substrate measured after 1 h...				Bioorg Med Chem 26: 637-646 (2018) Article DOI: 10.1016/j.bmc.2017.12.025 BindingDB Entry DOI: 10.7270/Q2JD50FF
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50460042 (CHEMBL4228946) Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1 Show InChI InChI=1S/C21H17F2N5O4S2/c1-10-14-8-17(33-20(14)27-21(25-10)26-11(2)29)12-6-16(19(32-3)24-9-12)28-34(30,31)18-5-4-13(22)7-15(18)23/h4-9,28H,1-3H3,(H,25,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences and Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of recombinant N-terminal FLAG-tagged human mTOR (1362 to end residues) using ULight-4E-BP1 peptide as substrate measured after 1 hr by LA...				Bioorg Med Chem 26: 637-646 (2018) Article DOI: 10.1016/j.bmc.2017.12.025 BindingDB Entry DOI: 10.7270/Q2JD50FF
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50460042 (CHEMBL4228946) Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1 Show InChI InChI=1S/C21H17F2N5O4S2/c1-10-14-8-17(33-20(14)27-21(25-10)26-11(2)29)12-6-16(19(32-3)24-9-12)28-34(30,31)18-5-4-13(22)7-15(18)23/h4-9,28H,1-3H3,(H,25,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.20	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences and Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of PI3Kdelta (unknown origin) using PIP2 as substrate measured after 1 hr by Kinase-Glo luminescence assay				Bioorg Med Chem 26: 637-646 (2018) Article DOI: 10.1016/j.bmc.2017.12.025 BindingDB Entry DOI: 10.7270/Q2JD50FF
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50460042 (CHEMBL4228946) Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1 Show InChI InChI=1S/C21H17F2N5O4S2/c1-10-14-8-17(33-20(14)27-21(25-10)26-11(2)29)12-6-16(19(32-3)24-9-12)28-34(30,31)18-5-4-13(22)7-15(18)23/h4-9,28H,1-3H3,(H,25,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences and Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged PI3Kbeta catalytic domain (155 to 1383 residues) expressed in baculovirus expression system usi...				Bioorg Med Chem 26: 637-646 (2018) Article DOI: 10.1016/j.bmc.2017.12.025 BindingDB Entry DOI: 10.7270/Q2JD50FF
					More data for this Ligand-Target Pair