Ferroptosis-centered Drug Response Information
General Information of the Drug (ID: ferrodrug0374)
| Name |
VBIT-12
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| Synonyms |
VBIT-12; 2089227-65-4; N-[[1-(1-naphthalenylmethyl)-4-(phenylamino)-4-piperidinyl]carbonyl]-glycine; 2-[[4-anilino-1-(naphthalen-1-ylmethyl)piperidine-4-carbonyl]amino]acetic acid; VBIT12; VBIT 12; SCHEMBL19972411; BCP32721; EX-A3741; s8936; AKOS040759338; AC-36876; HY-135885; CS-0115969; (1-(Naphthalen-1-ylmethyl)-4-(phenylamino)piperidine-4-carbonyl)glycine
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| Structure |
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| Formula |
C25H27N3O3
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| IUPAC Name |
2-[[4-anilino-1-(naphthalen-1-ylmethyl)piperidine-4-carbonyl]amino]acetic acid
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| Canonical SMILES |
C1CN(CCC1(C(=O)NCC(=O)O)NC2=CC=CC=C2)CC3=CC=CC4=CC=CC=C43
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| InChI |
InChI=1S/C25H27N3O3/c29-23(30)17-26-24(31)25(27-21-10-2-1-3-11-21)13-15-28(16-14-25)18-20-9-6-8-19-7-4-5-12-22(19)20/h1-12,27H,13-18H2,(H,26,31)(H,29,30)
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| InChIKey |
JZDHWOWCHGYSGA-UHFFFAOYSA-N
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| PubChem CID | |||||
Full List of Ferroptosis Target Related to This Drug
Unspecific Target
| In total 1 item(s) under this Target | |||||
| Experiment 1 Reporting the Ferroptosis-centered Drug Act on This Target | [1] | ||||
| Responsed Disease | Injury of intra-abdominal organs | ICD-11: NB91 | |||
| Responsed Regulator | Sphingomyelin phosphodiesterase (SMPD1) | Suppressor | |||
| Pathway Response | Fatty acid metabolism | hsa01212 | |||
| Ferroptosis | hsa04216 | ||||
| Cell Process | Cell ferroptosis | ||||
| In Vitro Model | mPHs (Mouse primary hepatocytes) | ||||
| In Vivo Model |
Male C57 BL /6J mice (6-8 weeks; 18-22 g each) were procured from the Experimental Animal Centre of Shanghai SLAC. All mice were fed in laboratory in vivo facilities with ad libitum food and water, within a temperature-/humidity-regulated environment (22 ± 1 ; Rh. = 65 ± 5%), adopting a 12-h circadian cycling process. Mice fasted overnight for 12 h and were randomly divided into different groups.
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| Response regulation | The relative amounts of CER and CL in the liver tissues of VBIT-12- or UAMC3203-treated APAP-injured mice markedly increased compared to those of APAP-injured mice. Smpd1 was the CER synthesis gene that was most significantly upregulated by UAMC3203 and VBIT-12. In summary, protecting mitochondria via inhibiting VDAC1 oligomerization alleviates ferroptosis in acetaminophen-induced acute liver injury. | ||||