BDBM50218891 7-iodoindirubin-3-acetoxime::CHEMBL395077

SMILES: CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2I

InChI Key: InChIKey=AZLQEBOVOFBYGA-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 = 50218891   

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
Aurora kinase B (Homo sapiens (Human))	BDBM50218891 (7-iodoindirubin-3-acetoxime | CHEMBL395077) Show SMILES CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2I |w:6.6,4.3| Show InChI InChI=1S/C18H12IN3O3/c1-9(23)25-22-16-10-5-2-3-8-13(10)20-17(16)14-11-6-4-7-12(19)15(11)21-18(14)24/h2-8,20H,1H3,(H,21,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Athens Curated by ChEMBL					Assay Description Inhibition of human recombinant aurora B kinase				J Med Chem 50: 4027-37 (2007) Article DOI: 10.1021/jm070077z BindingDB Entry DOI: 10.7270/Q2PC323X
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50218891 (7-iodoindirubin-3-acetoxime | CHEMBL395077) Show SMILES CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2I |w:6.6,4.3| Show InChI InChI=1S/C18H12IN3O3/c1-9(23)25-22-16-10-5-2-3-8-13(10)20-17(16)14-11-6-4-7-12(19)15(11)21-18(14)24/h2-8,20H,1H3,(H,21,24)	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	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Athens Curated by ChEMBL					Assay Description Inhibition of human recombinant aurora A kinase				J Med Chem 50: 4027-37 (2007) Article DOI: 10.1021/jm070077z BindingDB Entry DOI: 10.7270/Q2PC323X
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C (Homo sapiens (Human))	BDBM50218891 (7-iodoindirubin-3-acetoxime | CHEMBL395077) Show SMILES CC(=O)ON=C1C(Nc2ccccc12)=C1C(=O)Nc2c1cccc2I |w:6.6,4.3| Show InChI InChI=1S/C18H12IN3O3/c1-9(23)25-22-16-10-5-2-3-8-13(10)20-17(16)14-11-6-4-7-12(19)15(11)21-18(14)24/h2-8,20H,1H3,(H,21,24)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Athens Curated by ChEMBL					Assay Description Inhibition of human recombinant aurora C kinase				J Med Chem 50: 4027-37 (2007) Article DOI: 10.1021/jm070077z BindingDB Entry DOI: 10.7270/Q2PC323X
					More data for this Ligand-Target Pair