BDBM50153917 3-{1-Hydroxy-3-[4-(4-methanesulfonyl-benzyl)-[1,4]diazepan-1-yl]-1-phenyl-propyl}-phenol::CHEMBL182958

SMILES: CS(=O)(=O)c1ccc(CN2CCCN(CCC(O)(c3ccccc3)c3cccc(O)c3)CC2)cc1

InChI Key: InChIKey=SOSNLMJBMBKLPD-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50153917   

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 2 (Homo sapiens (Human))	BDBM50153917 (3-{1-Hydroxy-3-[4-(4-methanesulfonyl-benzyl)-[1,4]...) Show SMILES CS(=O)(=O)c1ccc(CN2CCCN(CCC(O)(c3ccccc3)c3cccc(O)c3)CC2)cc1 Show InChI InChI=1S/C28H34N2O4S/c1-35(33,34)27-13-11-23(12-14-27)22-30-17-6-16-29(19-20-30)18-15-28(32,24-7-3-2-4-8-24)25-9-5-10-26(31)21-25/h2-5,7-14,21,31-32H,6,15-20,22H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
Deltagen Research Laboratories Curated by ChEMBL					Assay Description Concentration required to inhibit [125I]-MCP-1 binding to Chemokine receptor 2B				Bioorg Med Chem Lett 14: 5413-6 (2004) Article DOI: 10.1016/j.bmcl.2004.08.009 BindingDB Entry DOI: 10.7270/Q2W958PZ
					More data for this Ligand-Target Pair
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50153917 (3-{1-Hydroxy-3-[4-(4-methanesulfonyl-benzyl)-[1,4]...) Show SMILES CS(=O)(=O)c1ccc(CN2CCCN(CCC(O)(c3ccccc3)c3cccc(O)c3)CC2)cc1 Show InChI InChI=1S/C28H34N2O4S/c1-35(33,34)27-13-11-23(12-14-27)22-30-17-6-16-29(19-20-30)18-15-28(32,24-7-3-2-4-8-24)25-9-5-10-26(31)21-25/h2-5,7-14,21,31-32H,6,15-20,22H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Bio-medical Research Curated by ChEMBL					Assay Description Concentration required to inhibit [125I]-MCP-1 (Monocyte Chemoattractant Protein-1) binding to THP-1 cell				Bioorg Med Chem Lett 14: 5407-11 (2004) Article DOI: 10.1016/j.bmcl.2004.08.008 BindingDB Entry DOI: 10.7270/Q2125S4T
					More data for this Ligand-Target Pair