BDBM50167439 CHEMBL189206::Isoquinoline-1-carboxylic acid [1'-(3,4-dichloro-benzyl)-[1,4']bipiperidinyl-3-ylmethyl]-amide

SMILES: Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3nccc4ccccc34)C2)cc1Cl

InChI Key: InChIKey=FYWJICYTASRDFO-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50167439   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
C-C chemokine receptor type 3 (Homo sapiens (Human))	BDBM50167439 (CHEMBL189206 | Isoquinoline-1-carboxylic acid [1'-...) Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3nccc4ccccc34)C2)cc1Cl Show InChI InChI=1S/C28H32Cl2N4O/c29-25-8-7-20(16-26(25)30)18-33-14-10-23(11-15-33)34-13-3-4-21(19-34)17-32-28(35)27-24-6-2-1-5-22(24)9-12-31-27/h1-2,5-9,12,16,21,23H,3-4,10-11,13-15,17-19H2,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering Plough Research Institute Curated by ChEMBL					Assay Description In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand				Bioorg Med Chem Lett 15: 3020-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.054 BindingDB Entry DOI: 10.7270/Q23T9GRW
					More data for this Ligand-Target Pair