Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 502.6 BDBM389817

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))	BDBM389817 (US9951063, 136) Show SMILES C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1cccc2CCN(Cc12)C(=O)OCc1ccccc1 Show InChI InChI=1S/C28H34N6O3/c1-20-16-31(14-15-33(20)27(35)18-34-22(3)29-21(2)30-34)26-11-7-10-24-12-13-32(17-25(24)26)28(36)37-19-23-8-5-4-6-9-23/h4-11,20H,12-19H2,1-3H3/t20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	33.2	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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