null

SMILES: COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3cc(C)on3)nn2)c1

InChI Key: InChIKey=RVJYTRQUACDTGA-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50160896   

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))	BDBM50160896 (CHEMBL3794450) Show SMILES COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3cc(C)on3)nn2)c1 Show InChI InChI=1S/C22H20N6O5/c1-13-8-20(26-33-13)23-11-16-12-28(27-25-16)17-6-7-19(29)18(10-17)21(30)24-15-5-3-4-14(9-15)22(31)32-2/h3-10,12,29H,11H2,1-2H3,(H,23,26)(H,24,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Inhibition of human Aurora A using H-LRRASLG as substrate after 2 hrs by HotSpot assay in presence of 33P-ATP and 10 uM ATP				Bioorg Med Chem 24: 2114-24 (2016) BindingDB Entry DOI: 10.7270/Q2ZW1NST
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50160896 (CHEMBL3794450) Show SMILES COC(=O)c1cccc(NC(=O)c2cc(ccc2O)-n2cc(CNc3cc(C)on3)nn2)c1 Show InChI InChI=1S/C22H20N6O5/c1-13-8-20(26-33-13)23-11-16-12-28(27-25-16)17-6-7-19(29)18(10-17)21(30)24-15-5-3-4-14(9-15)22(31)32-2/h3-10,12,29H,11H2,1-2H3,(H,23,26)(H,24,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	5.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Inhibition of human Aurora B using H-LRRASLG as substrate after 2 hrs by HotSpot assay in presence of 33P-ATP and 10 uM ATP				Bioorg Med Chem 24: 2114-24 (2016) BindingDB Entry DOI: 10.7270/Q2ZW1NST
					More data for this Ligand-Target Pair