BDBM50113303 2-Chloro-4-{5-[1-(3-chloro-phenyl)-3-methyl-5-oxo-1,5-dihydro-pyrazol-4-ylidenemethyl]-furan-2-yl}-benzoic acid anion

SMILES: [O-]C(=O)c1ccc(cc1Cl)-c1ccc(C=c2c(=C)[nH]n(-c3cccc(Cl)c3)c2=O)o1

InChI Key: InChIKey=IFFGDHUBPGAAOO-UHFFFAOYSA-M

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 = 50113303   

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))	BDBM50113303 (2-Chloro-4-{5-[1-(3-chloro-phenyl)-3-methyl-5-oxo-...) Show SMILES [O-]C(=O)c1ccc(cc1Cl)-c1ccc(C=c2c(=C)[nH]n(-c3cccc(Cl)c3)c2=O)o1 |w:14.14| Show InChI InChI=1S/C22H14Cl2N2O4/c1-12-18(21(27)26(25-12)15-4-2-3-14(23)10-15)11-16-6-8-20(30-16)13-5-7-17(22(28)29)19(24)9-13/h2-11,25H,1H2,(H,28,29)/p-1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.93E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human Protein-tyrosine phosphatase 1B (PTP1B) dephosphorylation of insulin receptor peptide				J Med Chem 45: 2213-21 (2002) BindingDB Entry DOI: 10.7270/Q2SB46F1
					More data for this Ligand-Target Pair