BDBM50335325 2-Isobutyl-4-(5-methyl-1H-pyrazol-3-ylamino)-2H-phthalazin-1-one::CHEMBL1651490

SMILES: CC(C)Cn1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O

InChI Key: InChIKey=SNLGNBKBVNOLQN-UHFFFAOYSA-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 = 50335325   

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 A (Homo sapiens (Human))	BDBM50335325 (2-Isobutyl-4-(5-methyl-1H-pyrazol-3-ylamino)-2H-ph...) Show SMILES CC(C)Cn1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O Show InChI InChI=1S/C16H19N5O/c1-10(2)9-21-16(22)13-7-5-4-6-12(13)15(20-21)17-14-8-11(3)18-19-14/h4-8,10H,9H2,1-3H3,(H2,17,18,19,20)	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	115	n/a	n/a	n/a	n/a	n/a	n/a
Evotec (UK) Ltd. Curated by ChEMBL					Assay Description Inhibition of Aurora A by ELISA				J Med Chem 54: 312-9 (2011) Article DOI: 10.1021/jm101346r BindingDB Entry DOI: 10.7270/Q29P32MB
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50335325 (2-Isobutyl-4-(5-methyl-1H-pyrazol-3-ylamino)-2H-ph...) Show SMILES CC(C)Cn1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O Show InChI InChI=1S/C16H19N5O/c1-10(2)9-21-16(22)13-7-5-4-6-12(13)15(20-21)17-14-8-11(3)18-19-14/h4-8,10H,9H2,1-3H3,(H2,17,18,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Evotec (UK) Ltd. Curated by ChEMBL					Assay Description Inhibition of Aurora B by ELISA				J Med Chem 54: 312-9 (2011) Article DOI: 10.1021/jm101346r BindingDB Entry DOI: 10.7270/Q29P32MB
					More data for this Ligand-Target Pair