Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 522.0 BDBM50062978

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))	BDBM50062978 (CHEMBL3398001) Show SMILES CC(=O)N1CCC(CC1)C(=O)N(CCCN1CCN(CC1)c1ccc(cc1)C#N)c1ccc(C)c(Cl)c1 Show InChI InChI=1S/C29H36ClN5O2/c1-22-4-7-27(20-28(22)30)35(29(37)25-10-14-33(15-11-25)23(2)36)13-3-12-32-16-18-34(19-17-32)26-8-5-24(21-31)6-9-26/h4-9,20,25H,3,10-19H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Antagonist activity against CCR5 (unknown origin) expressed in CHO cells co-expressing Galpha16 incubated for 10 mins assessed as inhibition of RANTE...				Bioorg Med Chem 23: 1157-68 (2015) Article DOI: 10.1016/j.bmc.2014.12.052 BindingDB Entry DOI: 10.7270/Q2WH2RN7
					More data for this Ligand-Target Pair