BDBM50177324 2-(4-(7-pentadecanoylcyclopenta[d][1,2]oxazin-4-yl)phenoxy)acetic acid::CHEMBL371026

SMILES: CCCCCCCCCCCCCCC(=O)c1ccc2c(nocc12)-c1ccc(OCC(O)=O)cc1

InChI Key: InChIKey=WQFVOXVVIRFYSH-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50177324   

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))	BDBM50177324 (2-(4-(7-pentadecanoylcyclopenta[d][1,2]oxazin-4-yl...) Show SMILES CCCCCCCCCCCCCCC(=O)c1ccc2c(nocc12)-c1ccc(OCC(O)=O)cc1 Show InChI InChI=1S/C30H39NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-28(32)25-19-20-26-27(25)21-36-31-30(26)23-15-17-24(18-16-23)35-22-29(33)34/h15-21H,2-14,22H2,1H3,(H,33,34)	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	270	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibitory activity against recombinant human PTP1B				Bioorg Med Chem Lett 16: 499-502 (2005) Article DOI: 10.1016/j.bmcl.2005.10.062 BindingDB Entry DOI: 10.7270/Q2319VFG
					More data for this Ligand-Target Pair