Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 514.5 BDBM389806

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
C-X-C chemokine receptor type 3 (Homo sapiens (Human))	BDBM389806 (US9951063, 125) Show SMILES C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1cccc2CCN(Cc12)c1cnc(nc1)C(F)(F)F Show InChI InChI=1S/C25H29F3N8O/c1-16-13-34(9-10-35(16)23(37)15-36-18(3)31-17(2)32-36)22-6-4-5-19-7-8-33(14-21(19)22)20-11-29-24(30-12-20)25(26,27)28/h4-6,11-12,16H,7-10,13-15H2,1-3H3/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	47.4	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA					Assay Description The bioactivity of compounds is tested in a fluorometric imaging plate reader (FLIPR: Molecular Devices) using engineered CHO-K1 cells expressing the...				Bioorg Med Chem Lett 17: 3473-9 (2007) BindingDB Entry DOI: 10.7270/Q20R9RRK
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