BDBM50203700 CHEMBL3921081

SMILES: COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C)C3)c2c1

InChI Key: InChIKey=JBCVLFFNJOTCGR-INIZCTEOSA-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 = 50203700   

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))	BDBM50203700 (CHEMBL3921081) Show SMILES COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C)C3)c2c1 |r| Show InChI InChI=1S/C21H23N3O3/c1-24-9-8-16(12-24)27-21-17-10-14(4-6-18(17)22-13-23-21)15-5-7-19(25-2)20(11-15)26-3/h4-7,10-11,13,16H,8-9,12H2,1-3H3/t16-/m0/s1	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	888	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PI3K-alpha (unknown origin) by KinaseGlo assay				Bioorg Med Chem Lett 26: 5657-5662 (2016) Article DOI: 10.1016/j.bmcl.2016.10.069 BindingDB Entry DOI: 10.7270/Q20Z7574
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM50203700 (CHEMBL3921081) Show SMILES COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C)C3)c2c1 |r| Show InChI InChI=1S/C21H23N3O3/c1-24-9-8-16(12-24)27-21-17-10-14(4-6-18(17)22-13-23-21)15-5-7-19(25-2)20(11-15)26-3/h4-7,10-11,13,16H,8-9,12H2,1-3H3/t16-/m0/s1	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	1.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PI3K-gamma (unknown origin) by KinaseGlo assay				Bioorg Med Chem Lett 26: 5657-5662 (2016) Article DOI: 10.1016/j.bmcl.2016.10.069 BindingDB Entry DOI: 10.7270/Q20Z7574
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform (Homo sapiens (Human))	BDBM50203700 (CHEMBL3921081) Show SMILES COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C)C3)c2c1 |r| Show InChI InChI=1S/C21H23N3O3/c1-24-9-8-16(12-24)27-21-17-10-14(4-6-18(17)22-13-23-21)15-5-7-19(25-2)20(11-15)26-3/h4-7,10-11,13,16H,8-9,12H2,1-3H3/t16-/m0/s1	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	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PI3K-beta (unknown origin) by KinaseGlo assay				Bioorg Med Chem Lett 26: 5657-5662 (2016) Article DOI: 10.1016/j.bmcl.2016.10.069 BindingDB Entry DOI: 10.7270/Q20Z7574
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50203700 (CHEMBL3921081) Show SMILES COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C)C3)c2c1 |r| Show InChI InChI=1S/C21H23N3O3/c1-24-9-8-16(12-24)27-21-17-10-14(4-6-18(17)22-13-23-21)15-5-7-19(25-2)20(11-15)26-3/h4-7,10-11,13,16H,8-9,12H2,1-3H3/t16-/m0/s1	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	130	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of PI3K-delta (unknown origin) by KinaseGlo assay				Bioorg Med Chem Lett 26: 5657-5662 (2016) Article DOI: 10.1016/j.bmcl.2016.10.069 BindingDB Entry DOI: 10.7270/Q20Z7574
					More data for this Ligand-Target Pair