BDBM87576 MLS001100779::N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-4-yl)oxy-benzamide::N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide::N-[(3-ethyl-5-isoxazolyl)methyl]-4-methoxy-3-[(1-propan-2-yl-4-piperidinyl)oxy]benzamide::N-[(3-ethylisoxazol-5-yl)methyl]-3-[(1-isopropyl-4-piperidyl)oxy]-4-methoxy-benzamide::SMR000658847::cid_24793407
SMILES: CCc1cc(CNC(=O)c2ccc(OC)c(OC3CCN(CC3)C(C)C)c2)on1
InChI Key: InChIKey=RDTZHYIKUCEPIX-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
High-affinity choline transporter (Homo sapiens (Human)) | BDBM87576 (MLS001100779 | N-[(3-ethyl-1,2-oxazol-5-yl)methyl]...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University Medical Center Curated by ChEMBL | Assay Description Inhibition of human CHT Leu530Ala and Val531Ala mutant expressed in HEK293 cells by membrane depolarization assay | Bioorg Med Chem Lett 25: 1757-60 (2015) Article DOI: 10.1016/j.bmcl.2015.02.058 BindingDB Entry DOI: 10.7270/Q24J0GTX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
High-affinity choline transporter (Homo sapiens (Human)) | BDBM87576 (MLS001100779 | N-[(3-ethyl-1,2-oxazol-5-yl)methyl]...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 18.9 | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins Ion Channel Center Curated by PubChem BioAssay | Assay Description Data Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center Affiliation: Johns Hopkins University, School of Medicine Screening ... | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2GT5KR1 | |||||||||||
More data for this Ligand-Target Pair |