BDBM50236790 CHEMBL4082319

SMILES: CN1CCN(Cc2cn(c3cccc(Cl)c23)S(=O)(=O)c2ccccc2Br)CC1

InChI Key: InChIKey=HJZLVBHEEHLAFX-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 = 50236790   

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))	BDBM50236790 (CHEMBL4082319) Show SMILES CN1CCN(Cc2cn(c3cccc(Cl)c23)S(=O)(=O)c2ccccc2Br)CC1 Show InChI InChI=1S/C20H21BrClN3O2S/c1-23-9-11-24(12-10-23)13-15-14-25(18-7-4-6-17(22)20(15)18)28(26,27)19-8-3-2-5-16(19)21/h2-8,14H,9-13H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Suven Life Sciences Ltd Curated by ChEMBL					Assay Description Inhibitory concentration against Herpes simplex virus type 1 thymidine kinase(HSV-1 TK)				J Med Chem 60: 1843-1859 (2017) Article DOI: 10.1021/acs.jmedchem.6b01662 BindingDB Entry DOI: 10.7270/Q27S7R1X
					More data for this Ligand-Target Pair