Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 576.7 BDBM50141835

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-C chemokine receptor type 5 (Homo sapiens (Human))	BDBM50141835 (CHEMBL366439 | Cyclohexyl-{3-[4-(5-naphthalen-1-yl...) Show SMILES OC(=O)[C@@H](C1CCCCC1)N1C[C@H](CN2CCC(CC2)c2cc(n[nH]2)-c2cccc3ccccc23)[C@H](C1)c1ccccc1 Show InChI InChI=1S/C37H44N4O2/c42-37(43)36(29-13-5-2-6-14-29)41-24-30(33(25-41)27-10-3-1-4-11-27)23-40-20-18-28(19-21-40)34-22-35(39-38-34)32-17-9-15-26-12-7-8-16-31(26)32/h1,3-4,7-12,15-17,22,28-30,33,36H,2,5-6,13-14,18-21,23-25H2,(H,38,39)(H,42,43)/t30-,33+,36+/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.5	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human CX3C chemokine receptor 5 from GP120-membrane-based assay				Bioorg Med Chem Lett 14: 935-9 (2004) Article DOI: 10.1016/j.bmcl.2003.12.004 BindingDB Entry DOI: 10.7270/Q2PK0FKP
					More data for this Ligand-Target Pair