Drug Information

Drug General Information
Drug ID
DXE0ML
Drug Name
(R)-2-({(R)-2-[(R)-2-((S)-2-Amino-3-mercapto-propionylamino)-3-methyl-butyryl]-1,2,3,4-tetrahydro-isoquinolin-3-ylmethyl}-amino)-4-methylsulfanyl-butyric acid
Synonyms
CHEMBL311819
Indication Discovery agent Investigative [1587926]
Formula
C23H36N4O4S2
Canonical SMILES
CSCC[C@@H](NC[C@H]1Cc2ccccc2CN1C(=O)[C@H](NC(=O)[C@H](N)CS)C(C)C)C(=O)O
InChI
InChI=1S/C23H36N4O4S2/c1-14(2)20(26-21(28)18(24)13-32)22(29)27-12-16-7-5-4-6-15(16)10-17(27)11-25-19(23(30)31)8-9-33-3/h4-7,14,17-20,25,32H,8-13,24H2,1-3H3,(H,26,28)(H,30,31)/t17-,18-,19-,20-/m1/s1
InChIKey
MQDLRYJPTNFXGG-UAFMIMERSA-N
Target and Pathway
Target(s) Farnesyltransferase Target Info [1587926]
Protein farnesyltransferase beta subunit Target Info [1587926]
KEGG Pathway Terpenoid backbone biosynthesis
Biosynthesis of antibioticshsa00900:Terpenoid backbone biosynthesis
Biosynthesis of antibiotics
NetPath Pathway TSH Signaling Pathway
Reactome Apoptotic cleavage of cellular proteins
Inactivation, recovery and regulation of the phototransduction cascadeR-HSA-2514859:Inactivation, recovery and regulation of the phototransduction cascade
WikiPathways Visual phototransduction
Apoptotic execution phaseWP2776:Visual phototransduction
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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