TTD | Drug: D04TSV

Drug General Information
Drug ID	D04TSV
Former ID	DNC012404
Drug Name	CI-992
Drug Type	Small molecular drug
Indication	Hypertension [ICD9: 401; ICD10:I10-I16]		Terminated	[545148]
Structure		Download 2D MOL 3D MOL
Formula	C33H52N6O7S2
Canonical SMILES	CC(C)CC(C(C(CC1CCCCC1)NC(=O)C(CC2=CSC(=N2)N)NC(=O)C(CC3<br />=CC=CC=C3)NS(=O)(=O)N4CCOCC4)O)O
InChI	1S/C33H52N6O7S2/c1-22(2)17-29(40)30(41)26(18-23-9-5-3-6-10-23)36-31(42)27(20-25-21-47-33(34)35-25)37-32(43)28(19-24-11-7-4-8-12-24)38-48(44,45)39-13-15-46-16-14-39/h4,7-8,11-12,21-23,26-30,38,40-41H,3,5-6,9-10,13-20H2,1-2H3,(H2,34,35)(H,36,42)(H,37,43)/t26-,27-,28-,29-,30+/m0/s1
InChIKey	QGJKHQRFJGLJLV-VFFRCKCKSA-N
PubChem Compound ID	9875002
Target and Pathway
Target(s)	Cathepsin D	Target Info	Inhibitor	[527925]
BioCyc Pathway	Thyroid hormone biosynthesis
KEGG Pathway	Sphingolipid signaling pathway
	Lysosome
	Tuberculosis
NetPath Pathway	IL2 Signaling Pathway
Pathway Interaction Database	LKB1 signaling events
	Ceramide signaling pathway
	Direct p53 effectors
	Validated nuclear estrogen receptor alpha network
Reactome	Collagen degradation
	Metabolism of Angiotensinogen to Angiotensins
	MHC class II antigen presentation
References
Ref 545148	Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800002298)
Ref 527925	J Med Chem. 1992 Jul 10;35(14):2562-72.Structure-activity relationships of a series of 2-amino-4-thiazole-containing renin inhibitors.

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.

Drug Information