BDBM50351776 CHEMBL1823964

SMILES: Cc1ccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)cc1

InChI Key: InChIKey=CTHXWTWENWSISP-RVDMUPIBSA-N

Data: 3 IC50

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 3 hits for monomerid = 50351776   

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
Dual specificity phosphatase Cdc25B (Homo sapiens (Human))	BDBM50351776 (CHEMBL1823964) Show SMILES Cc1ccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)cc1 Show InChI InChI=1S/C30H26FNO4/c1-20-6-8-21(9-7-20)11-15-29(33)32-28(30(34)35)17-22-10-12-24-18-26(14-13-23(24)16-22)36-19-25-4-2-3-5-27(25)31/h2-16,18,28H,17,19H2,1H3,(H,32,33)(H,34,35)/b15-11+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
Yanbian University Curated by ChEMBL					Assay Description Inhibition of human recombinant CDC25B				Eur J Med Chem 46: 3630-8 (2011) Article DOI: 10.1016/j.ejmech.2011.05.027 BindingDB Entry DOI: 10.7270/Q2W09685
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2 (Homo sapiens (Human))	BDBM50351776 (CHEMBL1823964) Show SMILES Cc1ccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)cc1 Show InChI InChI=1S/C30H26FNO4/c1-20-6-8-21(9-7-20)11-15-29(33)32-28(30(34)35)17-22-10-12-24-18-26(14-13-23(24)16-22)36-19-25-4-2-3-5-27(25)31/h2-16,18,28H,17,19H2,1H3,(H,32,33)(H,34,35)/b15-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
Yanbian University Curated by ChEMBL					Assay Description Inhibition of TCPTP				Eur J Med Chem 46: 3630-8 (2011) Article DOI: 10.1016/j.ejmech.2011.05.027 BindingDB Entry DOI: 10.7270/Q2W09685
					More data for this Ligand-Target Pair
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50351776 (CHEMBL1823964) Show SMILES Cc1ccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)cc1 Show InChI InChI=1S/C30H26FNO4/c1-20-6-8-21(9-7-20)11-15-29(33)32-28(30(34)35)17-22-10-12-24-18-26(14-13-23(24)16-22)36-19-25-4-2-3-5-27(25)31/h2-16,18,28H,17,19H2,1H3,(H,32,33)(H,34,35)/b15-11+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
Yanbian University Curated by ChEMBL					Assay Description Inhibition of PTP1B using p-nitrophenyl phosphate as substrate				Eur J Med Chem 46: 3630-8 (2011) Article DOI: 10.1016/j.ejmech.2011.05.027 BindingDB Entry DOI: 10.7270/Q2W09685
					More data for this Ligand-Target Pair