BDBM50264576 7-(5-(3-hydroxypropoxy)-1H-indol-2-yl)isoindolin-1-one::CHEMBL449663

SMILES: OCCCOc1ccc2[nH]c(cc2c1)-c1cccc2CNC(=O)c12

InChI Key: InChIKey=IOCFSLNXNXVRSR-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 = 50264576   

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
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50264576 (7-(5-(3-hydroxypropoxy)-1H-indol-2-yl)isoindolin-1...) Show SMILES OCCCOc1ccc2[nH]c(cc2c1)-c1cccc2CNC(=O)c12 Show InChI InChI=1S/C19H18N2O3/c22-7-2-8-24-14-5-6-16-13(9-14)10-17(21-16)15-4-1-3-12-11-20-19(23)18(12)15/h1,3-6,9-10,21-22H,2,7-8,11H2,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin)				Bioorg Med Chem Lett 18: 5130-3 (2008) Article DOI: 10.1016/j.bmcl.2008.07.090 BindingDB Entry DOI: 10.7270/Q2RF5TVZ
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50264576 (7-(5-(3-hydroxypropoxy)-1H-indol-2-yl)isoindolin-1...) Show SMILES OCCCOc1ccc2[nH]c(cc2c1)-c1cccc2CNC(=O)c12 Show InChI InChI=1S/C19H18N2O3/c22-7-2-8-24-14-5-6-16-13(9-14)10-17(21-16)15-4-1-3-12-11-20-19(23)18(12)15/h1,3-6,9-10,21-22H,2,7-8,11H2,(H,20,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Inhibition of CDK1 (unknown origin)				Bioorg Med Chem Lett 18: 5130-3 (2008) Article DOI: 10.1016/j.bmcl.2008.07.090 BindingDB Entry DOI: 10.7270/Q2RF5TVZ
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50264576 (7-(5-(3-hydroxypropoxy)-1H-indol-2-yl)isoindolin-1...) Show SMILES OCCCOc1ccc2[nH]c(cc2c1)-c1cccc2CNC(=O)c12 Show InChI InChI=1S/C19H18N2O3/c22-7-2-8-24-14-5-6-16-13(9-14)10-17(21-16)15-4-1-3-12-11-20-19(23)18(12)15/h1,3-6,9-10,21-22H,2,7-8,11H2,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Inhibition of Aurora A (unknown origin)				Bioorg Med Chem Lett 18: 5130-3 (2008) Article DOI: 10.1016/j.bmcl.2008.07.090 BindingDB Entry DOI: 10.7270/Q2RF5TVZ
					More data for this Ligand-Target Pair