BDBM50516349 CHEMBL4443279

SMILES: Fc1ccccc1Oc1nc(Nc2ccc(cc2)-c2nnn[nH]2)ncc1Cl

InChI Key: InChIKey=RLMODLUUZVLTGD-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 = 50516349   

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))	BDBM50516349 (CHEMBL4443279) Show SMILES Fc1ccccc1Oc1nc(Nc2ccc(cc2)-c2nnn[nH]2)ncc1Cl Show InChI InChI=1S/C17H11ClFN7O/c18-12-9-20-17(22-16(12)27-14-4-2-1-3-13(14)19)21-11-7-5-10(6-8-11)15-23-25-26-24-15/h1-9H,(H,20,21,22)(H,23,24,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.0120	n/a	n/a	n/a	n/a	n/a	n/a
Henan University of Chinese Medicine Curated by ChEMBL					Assay Description Inhibition of Aurora A (unknown origin)				Eur J Med Chem 178: 341-351 (2019) Article DOI: 10.1016/j.ejmech.2019.05.071
					More data for this Ligand-Target Pair