BDBM50448021 CHEMBL3115233

SMILES: CCCS(=O)(=O)N1CC(C1)C(NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1

InChI Key: InChIKey=YWPDEJOQYNUKLM-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 = 50448021   

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
Glycine transporter 2 (Homo sapiens (Human))	BDBM50448021 (CHEMBL3115233) Show SMILES CCCS(=O)(=O)N1CC(C1)C(NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C20H22Cl2N2O3S/c1-2-10-28(26,27)24-12-15(13-24)19(14-6-4-3-5-7-14)23-20(25)17-9-8-16(21)11-18(17)22/h3-9,11,15,19H,2,10,12-13H2,1H3,(H,23,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Inhibition of GlyT2 (unknown origin) assessed as [14C]-glycine transport				Bioorg Med Chem Lett 24: 1062-6 (2014) Article DOI: 10.1016/j.bmcl.2014.01.011 BindingDB Entry DOI: 10.7270/Q2XD1350
					More data for this Ligand-Target Pair
Glycine transporter 1 (Homo sapiens (Human))	BDBM50448021 (CHEMBL3115233) Show SMILES CCCS(=O)(=O)N1CC(C1)C(NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C20H22Cl2N2O3S/c1-2-10-28(26,27)24-12-15(13-24)19(14-6-4-3-5-7-14)23-20(25)17-9-8-16(21)11-18(17)22/h3-9,11,15,19H,2,10,12-13H2,1H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.27E+5	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Inhibition of GlyT1 (unknown origin) assessed as [14C]-glycine transport				Bioorg Med Chem Lett 24: 1062-6 (2014) Article DOI: 10.1016/j.bmcl.2014.01.011 BindingDB Entry DOI: 10.7270/Q2XD1350
					More data for this Ligand-Target Pair