Drug Information

Drug General Information
Drug ID
DX4VLC
Drug Name
3-(4-(4-bromophenylsulfonyl)phenyl)-4-propyl-1H-1,2,4-triazole-5(4H)-thione
Synonyms
CHEMBL427541
Indication Discovery agent Investigative [1587926]
Formula
C17H16BrN3O2S2
Canonical SMILES
CCCn1c(S)nnc1c2ccc(cc2)S(=O)(=O)c3ccc(Br)cc3
InChI
InChI=1S/C17H16BrN3O2S2/c1-2-11-21-16(19-20-17(21)24)12-3-7-14(8-4-12)25(22,23)15-9-5-13(18)6-10-15/h3-10H,2,11H2,1H3,(H,20,24)
InChIKey
XJAPTVGKEILQMA-UHFFFAOYSA-N
Target and Pathway
Target(s) Carbonic anhydrase II Target Info [1587926]
Carbonic anhydrase I Target Info [1587926]
KEGG Pathway Nitrogen metabolism
Proximal tubule bicarbonate reclamation
Collecting duct acid secretion
Gastric acid secretion
Pancreatic secretion
Bile secretionhsa00910:Nitrogen metabolism
NetPath Pathway IL4 Signaling Pathway
EGFR1 Signaling Pathway
Pathway Interaction Database C-MYB transcription factor network
PathWhiz Pathway Gastric Acid Production
Reactome Erythrocytes take up carbon dioxide and release oxygen
Erythrocytes take up oxygen and release carbon dioxide
Reversible hydration of carbon dioxideR-HSA-1237044:Erythrocytes take up carbon dioxide and release oxygen
Reversible hydration of carbon dioxide
WikiPathways Reversible Hydration of Carbon Dioxide
Uptake of Carbon Dioxide and Release of Oxygen by Erythrocytes
Uptake of Oxygen and Release of Carbon Dioxide by ErythrocytesWP2770:Reversible Hydration of Carbon Dioxide
Uptake of Oxygen and Release of Carbon Dioxide by Erythrocytes
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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