Details of the Drug-Related molecule(s) Activity Atlas

General Information of Drug (ID: DM053KT)

Drug Name
Aprepitant Drug Info
Synonyms
Aprepitant [USAN]; L 754030; MK 0869; Emend (TN); L-754030; MK-0869; ONO-7436; Aprepitant (JAN/USAN/INN); MK-869, L-754030, Emend, Aprepitant; 3-(((2R,3S)-3-(p-Fluorophenyl)-2-(((alphaR)-alpha-methyl-3,5-bis(trifluoromethyl)benzyl)oxy)morpholino)methyl)-Delta(2)-1,2,4-triazolin-5-one; 3-(((2R,3S)-3-(p-Fluorophenyl)-2-(((alphaR)-alpha-methyl-3,5-bis(trifluoromethyl)benzyl)oxy)morpholino)methyl)-delta(sup 2)-1,2,4-triazolin-5-one; 5-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one; 5-[[(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one; 5-{[(2R,3S)-2-{(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholin-4-yl]methyl}-2,4-dihydro-3H-1,2,4-triazol-3-one
Therapeutic Class
Antiemetics
Cross-matching ID
PubChem CID
135413536
ChEBI ID
CHEMBL1471
CAS Number
CAS 170729-80-3
TTD ID
D0GU4K
VARIDT Drug ID
DR01398
INTEDE Drug ID
DR0125
ACDINA Drug ID
D00042

Molecule-level Activity Landscape of This Drug
Molecule Name Gene Name UniProt ID Type IC50 (nM) Details
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Molecule Name Gene Name UniProt ID Type Kd (nM) Details
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Molecule Name Gene Name UniProt ID Type Ki (nM) Details
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Cytotoxic Activity Landscape of This Drug

Cell Line Disease Value (nM) ChEMBL Assay ID Details
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