BDBM50165627 (2-{4-[2-(3-Fluoro-4-methoxy-phenylcarbamoyl)-vinyl]-phenyl}-benzooxazol-5-yl)-acetic acid::2-(2-(4-(3-(3-fluoro-4-methoxyphenylamino)-3-oxoprop-1-enyl)phenyl)benzo[d]oxazol-5-yl)acetic acid::CHEMBL383774
SMILES: COc1ccc(NC(=O)\C=C\c2ccc(cc2)-c2nc3cc(CC(O)=O)ccc3o2)cc1F
InChI Key: InChIKey=LBSLKIUXRJBSHP-VZUCSPMQSA-N
Data: 2 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Heparanase (Homo sapiens (Human)) | BDBM50165627 ((2-{4-[2-(3-Fluoro-4-methoxy-phenylcarbamoyl)-viny...) | PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 302 | n/a | n/a | n/a | n/a | n/a | n/a |
Sharif University of Technology Curated by ChEMBL | Assay Description Inhibition of heparanase | Eur J Med Chem 43: 548-56 (2008) Article DOI: 10.1016/j.ejmech.2007.04.014 BindingDB Entry DOI: 10.7270/Q2PC33KM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Heparanase (Homo sapiens (Human)) | BDBM50165627 ((2-{4-[2-(3-Fluoro-4-methoxy-phenylcarbamoyl)-viny...) | PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Celltech R&D Ltd Curated by ChEMBL | Assay Description In vitro inhibitory concentration against human Heparanase | Bioorg Med Chem Lett 15: 2295-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.014 BindingDB Entry DOI: 10.7270/Q2BP029G | |||||||||||
More data for this Ligand-Target Pair |