BDBM50315775 1-(4-(5-chloro-4-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl)phenyl)-N,N-dimethylmethanamine::CHEMBL1090832

SMILES: CN(C)Cc1ccc(cc1)-c1cc2c(-c3cnn(C)c3)c(Cl)cnc2[nH]1

InChI Key: InChIKey=QWJHWNIFEWOQTF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50315775   

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))	BDBM50315775 (1-(4-(5-chloro-4-(1-methyl-1H-pyrazol-4-yl)-1H-pyr...) Show SMILES CN(C)Cc1ccc(cc1)-c1cc2c(-c3cnn(C)c3)c(Cl)cnc2[nH]1 Show InChI InChI=1S/C20H20ClN5/c1-25(2)11-13-4-6-14(7-5-13)18-8-16-19(15-9-23-26(3)12-15)17(21)10-22-20(16)24-18/h4-10,12H,11H2,1-3H3,(H,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of aurora B assessed as inhibition of histone H3 phosphorylation by ELISA based cellular mechanistic assay				Bioorg Med Chem Lett 20: 2552-5 (2010) Article DOI: 10.1016/j.bmcl.2010.02.091 BindingDB Entry DOI: 10.7270/Q2WS8TDZ
					More data for this Ligand-Target Pair