Drug Information

Drug General Information
Drug ID
DX1TV4
Drug Name
4-(3-(4-sulfamoylphenethyl)thioureido)benzoic acid
Synonyms
CHEMBL461963
Indication Discovery agent Investigative [1587926]
Formula
C16H17N3O4S2
Canonical SMILES
NS(=O)(=O)c1ccc(CCNC(=S)Nc2ccc(cc2)C(=O)O)cc1
InChI
InChI=1S/C16H17N3O4S2/c17-25(22,23)14-7-1-11(2-8-14)9-10-18-16(24)19-13-5-3-12(4-6-13)15(20)21/h1-8H,9-10H2,(H,20,21)(H2,17,22,23)(H2,18,19,24)
InChIKey
LEVVVKHQSKYBMK-UHFFFAOYSA-N
Target and Pathway
Target(s) Carbonic anhydrase II Target Info [1587926]
Carbonic anhydrase IX 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 HIF-1-alpha transcription factor network
Reactome Erythrocytes take up carbon dioxide and release oxygen
Erythrocytes take up oxygen and release carbon dioxide
Reversible hydration of carbon dioxideR-HSA-1234158:Regulation of gene expression by Hypoxia-inducible Factor
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 ErythrocytesWP2877:Vitamin D Receptor Pathway
Regulation of Hypoxia-inducible Factor (HIF) by Oxygen
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

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