BDBM50240434 2-[1-(6-Amino-purin-9-yl)-2-oxo-ethoxy]-propenal::CHEMBL280595
SMILES: Nc1ncnc2n(cnc12)C(OC(=C)C=O)C=O
InChI Key: InChIKey=VYBXRVWOQQROQZ-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Adenosylhomocysteinase (Homo sapiens (Human)) | BDBM50240434 (2-[1-(6-Amino-purin-9-yl)-2-oxo-ethoxy]-propenal |...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Compound was tested for inhibition of S-adenosyl homocysteine (SAH) hydrolase . | Bioorg Med Chem Lett 6: 1381-1386 (1996) Article DOI: 10.1016/0960-894X(96)00234-X BindingDB Entry DOI: 10.7270/Q29P31NC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine deaminase (Bos taurus (bovine)) | BDBM50240434 (2-[1-(6-Amino-purin-9-yl)-2-oxo-ethoxy]-propenal |...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | 7.0 | n/a |
TBA Curated by ChEMBL | Assay Description Inhibitory constant against adenosine deaminase in 0.05 M sodium phosphate buffer at pH 7.0 was determined before heating | J Med Chem 23: 795-8 (1980) BindingDB Entry DOI: 10.7270/Q29C6WGH | |||||||||||
More data for this Ligand-Target Pair |