BDBM50118754 6-(2-Biphenyl-4-yl-ethyl)-2-(oxalyl-amino)-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine-3-carboxylic acid::CHEMBL139196

SMILES: OC(=O)C(=O)Nc1sc2CN(CCc3ccc(cc3)-c3ccccc3)CCc2c1C(O)=O

InChI Key: InChIKey=OZDQHYCOGCUVHI-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50118754   

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
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50118754 (6-(2-Biphenyl-4-yl-ethyl)-2-(oxalyl-amino)-4,5,6,7...) Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccc(cc3)-c3ccccc3)CCc2c1C(O)=O Show InChI InChI=1S/C24H22N2O5S/c27-21(24(30)31)25-22-20(23(28)29)18-11-13-26(14-19(18)32-22)12-10-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-9H,10-14H2,(H,25,27)(H,28,29)(H,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Novo Nordisk A/S Curated by ChEMBL					Assay Description Inhibition of human recombinant Protein-tyrosine phosphatase 1B.				J Med Chem 45: 4443-59 (2002) BindingDB Entry DOI: 10.7270/Q2QJ7GM5
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2 (Homo sapiens (Human))	BDBM50118754 (6-(2-Biphenyl-4-yl-ethyl)-2-(oxalyl-amino)-4,5,6,7...) Show SMILES OC(=O)C(=O)Nc1sc2CN(CCc3ccc(cc3)-c3ccccc3)CCc2c1C(O)=O Show InChI InChI=1S/C24H22N2O5S/c27-21(24(30)31)25-22-20(23(28)29)18-11-13-26(14-19(18)32-22)12-10-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-9H,10-14H2,(H,25,27)(H,28,29)(H,30,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	7.0	n/a
Novo Nordisk A/S Curated by ChEMBL					Assay Description Inhibition of T cell protein tyrosine phosphatase (TC-PTP) at pH 7.0				J Med Chem 45: 4443-59 (2002) BindingDB Entry DOI: 10.7270/Q2QJ7GM5
					More data for this Ligand-Target Pair