BDBM50128899 (S)-Pyridin-4-ylmethyl-carbamic acid (R)-2-amino-3-hydroxy-octadec-4-enyl ester::CHEMBL416322
SMILES: CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COC(=O)NCc1ccncc1
InChI Key: InChIKey=CUDMUSNHAPMJDI-QREDHFMISA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Neutral sphingomyelinase (Rattus norvegicus) | BDBM50128899 ((S)-Pyridin-4-ylmethyl-carbamic acid (R)-2-amino-3...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Taisho Pharmaceutical Co., Ltd. Curated by ChEMBL | Assay Description Inhibitory concentration against the membrane neutral magnesium-dependent Sphingomyelinase (N-SMase) using rat brain microsomes as the enzyme source | Bioorg Med Chem Lett 13: 1963-6 (2003) BindingDB Entry DOI: 10.7270/Q2KD1ZFT | |||||||||||
More data for this Ligand-Target Pair |