BDBM224571 US9321773, 86

SMILES: CC(C)NC(=O)CCCC#Cc1cccc2nc(Cn3nc(-c4ccc(O)cc4)c4c(N)ncnc34)n(Cc3ccccc3Cl)c(=O)c12

InChI Key: InChIKey=DNAKNIPQHSVMLE-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 = 224571   

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))	BDBM224571 (US9321773, 86) Show SMILES CC(C)NC(=O)CCCC#Cc1cccc2nc(Cn3nc(-c4ccc(O)cc4)c4c(N)ncnc34)n(Cc3ccccc3Cl)c(=O)c12 Show InChI InChI=1S/C36H33ClN8O3/c1-22(2)41-30(47)14-5-3-4-9-23-11-8-13-28-31(23)36(48)44(19-25-10-6-7-12-27(25)37)29(42-28)20-45-35-32(34(38)39-21-40-35)33(43-45)24-15-17-26(46)18-16-24/h6-8,10-13,15-18,21-22,46H,3,5,14,19-20H2,1-2H3,(H,41,47)(H2,38,39,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Respivert, Ltd. US Patent					Assay Description PI3 kinases catalyse the phosphorylation of phosphatidylinositol 4,5-biphosphate (PIP2) to phosphatidylinositol 3,4,5-triphosphate (PIP3) in the pres...				US Patent US9321773 (2016) BindingDB Entry DOI: 10.7270/Q2MG7NCG
					More data for this Ligand-Target Pair
PI3-kinase class I (Homo sapiens (Human))	BDBM224571 (US9321773, 86) Show SMILES CC(C)NC(=O)CCCC#Cc1cccc2nc(Cn3nc(-c4ccc(O)cc4)c4c(N)ncnc34)n(Cc3ccccc3Cl)c(=O)c12 Show InChI InChI=1S/C36H33ClN8O3/c1-22(2)41-30(47)14-5-3-4-9-23-11-8-13-28-31(23)36(48)44(19-25-10-6-7-12-27(25)37)29(42-28)20-45-35-32(34(38)39-21-40-35)33(43-45)24-15-17-26(46)18-16-24/h6-8,10-13,15-18,21-22,46H,3,5,14,19-20H2,1-2H3,(H,41,47)(H2,38,39,40)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Respivert, Ltd. US Patent					Assay Description PI3 kinases catalyse the phosphorylation of phosphatidylinositol 4,5-biphosphate (PIP2) to phosphatidylinositol 3,4,5-triphosphate (PIP3) in the pres...				US Patent US9321773 (2016) BindingDB Entry DOI: 10.7270/Q2MG7NCG
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM224571 (US9321773, 86) Show SMILES CC(C)NC(=O)CCCC#Cc1cccc2nc(Cn3nc(-c4ccc(O)cc4)c4c(N)ncnc34)n(Cc3ccccc3Cl)c(=O)c12 Show InChI InChI=1S/C36H33ClN8O3/c1-22(2)41-30(47)14-5-3-4-9-23-11-8-13-28-31(23)36(48)44(19-25-10-6-7-12-27(25)37)29(42-28)20-45-35-32(34(38)39-21-40-35)33(43-45)24-15-17-26(46)18-16-24/h6-8,10-13,15-18,21-22,46H,3,5,14,19-20H2,1-2H3,(H,41,47)(H2,38,39,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Respivert, Ltd. US Patent					Assay Description PI3 kinases catalyse the phosphorylation of phosphatidylinositol 4,5-biphosphate (PIP2) to phosphatidylinositol 3,4,5-triphosphate (PIP3) in the pres...				US Patent US9321773 (2016) BindingDB Entry DOI: 10.7270/Q2MG7NCG
					More data for this Ligand-Target Pair