BDBM24523 (2E,5E)-2-{[4-(adamantan-1-yl)-1,3-thiazol-2-yl]imino}-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-1,3-thiazolidin-4-one::Thiazole analogue, 10
SMILES: COc1cc(\C=C2\S\C(NC2=O)=N\c2nc(cs2)C23CC4CC(CC(C4)C2)C3)ccc1O
InChI Key: InChIKey=XSYJDILFFHLZSW-UFWORHAWSA-N
Data: 1 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tyrosine-protein phosphatase non-receptor type 11 (Homo sapiens (Human)) | BDBM24523 ((2E,5E)-2-{[4-(adamantan-1-yl)-1,3-thiazol-2-yl]im...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1.23E+4 | -6.69 | n/a | n/a | n/a | n/a | n/a | 7.0 | 25 |
Aristotle University | Assay Description SHP-2 inhibitory activity was tested using human recombinant GST-fusion SHP-2 (Calbiochem). Test compound was preincubated with enzyme mixture before... | J Med Chem 51: 5221-8 (2008) Article DOI: 10.1021/jm8004306 BindingDB Entry DOI: 10.7270/Q2251GGD | |||||||||||
More data for this Ligand-Target Pair |