BDBM50422694 CHEMBL2093921

SMILES: OC[C@H]1O[C@@H]([C@@H](O)[C@H]1O)n1c(Br)nc2cc(Cl)c(Cl)cc12

InChI Key: InChIKey=NMAMPJIAXSGTLN-RCWTZXSCSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50422694   

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
Oligopeptide transporter small intestine isoform (Homo sapiens (Human))	BDBM50422694 (CHEMBL2093921) Show SMILES OC[C@H]1O[C@@H]([C@@H](O)[C@H]1O)n1c(Br)nc2cc(Cl)c(Cl)cc12 |r| Show InChI InChI=1S/C12H11BrCl2N2O4/c13-12-16-6-1-4(14)5(15)2-7(6)17(12)11-10(20)9(19)8(3-18)21-11/h1-2,8-11,18-20H,3H2/t8-,9+,10+,11+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.47E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Inhibitory concentration against [3H]glycylsarcosine uptake in HeLa cells expressing human Intestinal peptide transporter PepT1				J Med Chem 48: 1274-7 (2005) Article DOI: 10.1021/jm049450i BindingDB Entry DOI: 10.7270/Q2348M46
					More data for this Ligand-Target Pair