Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 440.4 BDBM379073

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mitotic checkpoint serine/threonine-protein kinase BUB1 (Homo sapiens (Human))	BDBM379073 (Preparation of 2-[1-(2-fluorobenzyl)-1H-indazol-3-...) Show SMILES COc1cnc(nc1N(C)c1ccncc1)-c1nn(Cc2ccccc2F)c2ccccc12 Show InChI InChI=1S/C25H21FN6O/c1-31(18-11-13-27-14-12-18)25-22(33-2)15-28-24(29-25)23-19-8-4-6-10-21(19)32(30-23)16-17-7-3-5-9-20(17)26/h3-15H,16H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical					Assay Description Bub1-inhibitory activities of compounds described in the present invention were quantified using a time-resolved fluorescence energy transfer (TR-FRE...				J Med Chem 51: 4150-69 (2008) BindingDB Entry DOI: 10.7270/Q2RV0R1M
					More data for this Ligand-Target Pair