BDBM50314366 4-hydroxy-2-((1-methyl-4-(4-(4-methylpiperazine-1-carbonyl)piperidin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl)methylene)benzofuran-3(2H)-one::CHEMBL1092486

SMILES: CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12

InChI Key: InChIKey=OZSMHSFVPXRVBD-KQWNVCNZSA-N

Data: 2 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 2 hits for monomerid = 50314366   

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
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50314366 (4-hydroxy-2-((1-methyl-4-(4-(4-methylpiperazine-1-...) Show SMILES CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12 Show InChI InChI=1S/C28H31N5O4/c1-30-12-14-33(15-13-30)28(36)18-7-10-32(11-8-18)20-6-9-29-27-24(20)19(17-31(27)2)16-23-26(35)25-21(34)4-3-5-22(25)37-23/h3-6,9,16-18,34H,7-8,10-15H2,1-2H3/b23-16-	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	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of mTOR				Bioorg Med Chem Lett 20: 2321-5 (2010) Article DOI: 10.1016/j.bmcl.2010.01.135 BindingDB Entry DOI: 10.7270/Q2PK0G82
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50314366 (4-hydroxy-2-((1-methyl-4-(4-(4-methylpiperazine-1-...) Show SMILES CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12 Show InChI InChI=1S/C28H31N5O4/c1-30-12-14-33(15-13-30)28(36)18-7-10-32(11-8-18)20-6-9-29-27-24(20)19(17-31(27)2)16-23-26(35)25-21(34)4-3-5-22(25)37-23/h3-6,9,16-18,34H,7-8,10-15H2,1-2H3/b23-16-	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	39	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha				Bioorg Med Chem Lett 20: 2321-5 (2010) Article DOI: 10.1016/j.bmcl.2010.01.135 BindingDB Entry DOI: 10.7270/Q2PK0G82
					More data for this Ligand-Target Pair