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

General Information of Drug (ID: DMXE0F2)

• Drug Name: PMID10498202C1 Drug Info
• Synonyms: 4oc6; GTPL6541; BDBM50080960

Indication

Disease Entry	ICD 11	Status	REF
Multiple sclerosis	8A40	Clinical trial	[1]

• Cross-matching ID:
  PubChem CID: 9876120
  TTD Drug ID: DMXE0F2

Molecule-Related Drug Atlas

Drug(s) Targeting Cathepsin D (CTSD)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
CI-992	DMBHYIJ	Hypertension	BA00-BA04	Terminated	[2]
Alpha-D-Mannose	DMF5DLW	Discovery agent	N.A.	Investigative	[3]
Grassystatin a	DM1PWX2	Discovery agent	N.A.	Investigative	[4]
PMID8410973C3	DM6J5KY	Discovery agent	N.A.	Investigative	[5]
KNI-10006	DMMISH6	Discovery agent	N.A.	Investigative	[6]
GRL-7234	DMR93MK	Discovery agent	N.A.	Investigative	[7]
S-Methylcysteine	DMAMRKS	Discovery agent	N.A.	Investigative	[3]
Carbocyclic Peptidomimetic	DM87SOX	Discovery agent	N.A.	Investigative	[8]
N-Aminoethylmorpholine	DMWXBYC	Discovery agent	N.A.	Investigative	[3]
1h-Benoximidazole-2-Carboxylic Acid	DMNZAVE	Discovery agent	N.A.	Investigative	[3]

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Cathepsin D (CTSD)	TTPT2QI	CATD_HUMAN	Inhibitor	[1]

References

• [1] Synthesis and structure activity relationships of novel small molecule cathepsin D inhibitors. Bioorg Med Chem Lett. 1999 Sep 6;9(17):2531-6.
• [2] Structure-activity relationships of a series of 2-amino-4-thiazole-containing renin inhibitors. J Med Chem. 1992 Jul 10;35(14):2562-72.
• [3] How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.
• [4] Grassystatins A-C from marine cyanobacteria, potent cathepsin E inhibitors that reduce antigen presentation. J Med Chem. 2009 Sep 24;52(18):5732-47.
• [5] Specificity in the binding of inhibitors to the active site of human/primate aspartic proteinases: analysis of P2-P1-P1'-P2' variation. J Med Chem. 1993 Sep 3;36(18):2614-20.
• [6] alpha-Substituted norstatines as the transition-state mimic in inhibitors of multiple digestive vacuole malaria aspartic proteases. Bioorg Med Chem. 2009 Aug 15;17(16):5933-49.
• [7] Design, synthesis, and X-ray structure of potent memapsin 2 (beta-secretase) inhibitors with isophthalamide derivatives as the P2-P3-ligands. J Med Chem. 2007 May 17;50(10):2399-407.
• [8] Structure-based design, synthesis, and memapsin 2 (BACE) inhibitory activity of carbocyclic and heterocyclic peptidomimetics. J Med Chem. 2005 Aug 11;48(16):5175-90.