Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 509.5 BDBM389821

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))	BDBM389821 (US9951063, 140) Show SMILES Cn1c2ccccc2n(CC(=O)N2CCN(CC2)c2cccc3CCN(Cc23)C(=O)c2ccccc2)c1=O Show InChI InChI=1S/C30H31N5O3/c1-31-26-11-5-6-12-27(26)35(30(31)38)21-28(36)33-18-16-32(17-19-33)25-13-7-10-22-14-15-34(20-24(22)25)29(37)23-8-3-2-4-9-23/h2-13H,14-21H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	51.2	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
					More data for this Ligand-Target Pair