BDBM124247 N-(6-(4-(furan-2-carboxamido)phenyl)pyridin-3-yl)furan-2-carboxamide (27)

SMILES: O=C(Nc1ccc(cc1)-c1ccc(NC(=O)c2ccco2)cn1)c1ccco1

InChI Key: InChIKey=RTXMIRNUBGYGGV-UHFFFAOYSA-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 = 124247   

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))	BDBM124247 (N-(6-(4-(furan-2-carboxamido)phenyl)pyridin-3-yl)f...) Show SMILES O=C(Nc1ccc(cc1)-c1ccc(NC(=O)c2ccco2)cn1)c1ccco1 Show InChI InChI=1S/C21H15N3O4/c25-20(18-3-1-11-27-18)23-15-7-5-14(6-8-15)17-10-9-16(13-22-17)24-21(26)19-4-2-12-28-19/h1-13H,(H,23,25)(H,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jiangnan University					Assay Description IC50 values were determined by pNPP assay.				Bioorg Med Chem Lett 24: 1889-94 (2014) Article DOI: 10.1016/j.bmcl.2014.03.015 BindingDB Entry DOI: 10.7270/Q2PC3122
					More data for this Ligand-Target Pair