BDBM50208745 CHEMBL3884239
SMILES: Nc1ncnc2n([C@@H]3O[C@H](CN=[N+]=[N-])[C@@H](O)[C@H]3O)c(SCC(=O)NCC#C)nc12
InChI Key: InChIKey=OWZAUGHCMPKEDC-FRJWGUMJSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NAD kinase (Homo sapiens (Human)) | BDBM50208745 (CHEMBL3884239) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.40E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
France; CNRS Curated by ChEMBL | Assay Description Inhibition of human NADK expressed in Escherichia coli BL21(DE3) assessed as reduction in NADP production using NAD as substrate by glucose-6-phospha... | Eur J Med Chem 124: 1041-1056 (2016) Article DOI: 10.1016/j.ejmech.2016.10.033 BindingDB Entry DOI: 10.7270/Q2WH2S1K | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
NAD kinase (NADK) (Staphylococcus aureus) | BDBM50208745 (CHEMBL3884239) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >4.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
France; CNRS Curated by ChEMBL | Assay Description Inhibition of Staphylococcus aureus COL NADK expressed in Escherichia coli BL21(DE3) assessed as reduction in NADP production using NAD as substrate ... | Eur J Med Chem 124: 1041-1056 (2016) Article DOI: 10.1016/j.ejmech.2016.10.033 BindingDB Entry DOI: 10.7270/Q2WH2S1K | |||||||||||
More data for this Ligand-Target Pair |