BDBM50416118 CHEMBL1083122

SMILES: COc1ccc(c2ccccc12)S(=O)(=O)N1CC(C(=O)NCCCN2CCOCC2)c2ccccc12

InChI Key: InChIKey=IWYSYZVYXJRDME-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 = 50416118   

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
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50416118 (CHEMBL1083122) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)N1CC(C(=O)NCCCN2CCOCC2)c2ccccc12 Show InChI InChI=1S/C27H31N3O5S/c1-34-25-11-12-26(22-9-3-2-8-21(22)25)36(32,33)30-19-23(20-7-4-5-10-24(20)30)27(31)28-13-6-14-29-15-17-35-18-16-29/h2-5,7-12,23H,6,13-19H2,1H3,(H,28,31)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31.6	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 Antagonist activity at human 5HT6 expressed in CHO cells by FLIPR 384 assay				Bioorg Med Chem Lett 20: 3713-6 (2010) Article DOI: 10.1016/j.bmcl.2010.04.085 BindingDB Entry DOI: 10.7270/Q2V69KV3
					More data for this Ligand-Target Pair