Drug General Information
Drug ID
DX3XNC
Drug Name
(S)-2-((2R)-1-((S)-2-((R)-2-amino-3-mercaptopropanamido)-3-methylbutanoyl)-octahydro-1H-indole-2-carboxamido)-4-(methylthio)butanoic acid
Synonyms
CHEMBL206754
Indication Discovery agent Investigative [1587926]
Formula
C22H38N4O5S2
Canonical SMILES
CSCC[C@H](NC(=O)[C@H]1CC2CCCCC2N1C(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(=O)O
InChI
InChI=1S/C22H38N4O5S2/c1-12(2)18(25-19(27)14(23)11-32)21(29)26-16-7-5-4-6-13(16)10-17(26)20(28)24-15(22(30)31)8-9-33-3/h12-18,32H,4-11,23H2,1-3H3,(H,24,28)(H,25,27)(H,30,31)/t13?,14-,15-,16?,17+,18-/m0/s1
InChIKey
YFAURVKAEFCMHI-YYQWJSNHSA-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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