BDBM50370610 CHEMBL608509

SMILES: O[C@H]1[C@@H](O)C(O[C@@H]1COC(=O)[C@@H]1CCCN1)n1c(Br)nc2cc(Cl)c(Cl)cc12

InChI Key: InChIKey=JAMOJPAGZNMVBP-ZYRDPKDJSA-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 = 50370610   

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))	BDBM50370610 (CHEMBL608509) Show SMILES O[C@H]1[C@@H](O)C(O[C@@H]1COC(=O)[C@@H]1CCCN1)n1c(Br)nc2cc(Cl)c(Cl)cc12 |r| Show InChI InChI=1S/C17H18BrCl2N3O5/c18-17-22-10-4-7(19)8(20)5-11(10)23(17)15-14(25)13(24)12(28-15)6-27-16(26)9-2-1-3-21-9/h4-5,9,12-15,21,24-25H,1-3,6H2/t9-,12+,13+,14+,15?/m0/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	5.37E+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