Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 550.5 BDBM389828

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))	BDBM389828 (US9951063, 147) Show SMILES C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1cc(F)c(F)c2CCN(Cc12)c1cnc(nc1)C(F)(F)F Show InChI InChI=1S/C25H27F5N8O/c1-14-11-36(6-7-37(14)22(39)13-38-16(3)33-15(2)34-38)21-8-20(26)23(27)18-4-5-35(12-19(18)21)17-9-31-24(32-10-17)25(28,29)30/h8-10,14H,4-7,11-13H2,1-3H3/t14-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.58	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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