Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0W7WC
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| Former ID |
DNAP001684
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| Drug Name |
Ivacaftor
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| Synonyms |
Kalydeco (TN)
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| Drug Type |
Small molecular drug
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| Indication | Cystic fibrosis [ICD-11: CA25; ICD-10: E84, E84.9; ICD-9: 277] | Approved | [1], [2], [3] | |
| Company |
Vertex
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| Structure |
 |
Download2D MOL |
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| Formula |
C24H28N2O3
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| Canonical SMILES |
CC(C)(C)C1=CC(=C(C=C1NC(=O)C2=CNC3=CC=CC=C3C2=O)O)C(C)(C)C
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| InChI |
1S/C24H28N2O3/c1-23(2,3)16-11-17(24(4,5)6)20(27)12-19(16)26-22(29)15-13-25-18-10-8-7-9-14(18)21(15)28/h7-13,27H,1-6H3,(H,25,28)(H,26,29)
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| InChIKey |
PURKAOJPTOLRMP-UHFFFAOYSA-N
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| CAS Number |
CAS 873054-44-5
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| PubChem Compound ID | ||||
| PubChem Substance ID |
24902571, 28764112, 40723266, 104253162, 118855344, 123051083, 124757031, 124950685, 125163835, 125299328, 125434146, 126661313, 126731535, 131480767, 134964550, 135264255, 135626653, 135653729, 135692075, 135727452, 136367331, 136367911, 136926964, 137031731, 137626819, 137626820, 144116089, 152134181, 152258419, 160645564, 160647255, 160874442, 162011579, 162037465, 162202744, 163894050, 164042021, 172919866, 175266660, 175427103, 178101159, 184819711, 187072829, 198993065, 223381530, 223471420, 223683825, 223705162, 224174132, 226685555
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| ChEBI ID |
CHEBI:66901
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| ADReCS Drug ID | BADD_D01220 | |||
| SuperDrug ATC ID |
R07AX02
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | cAMP-dependent chloride channel (CFTR) | Target Info | Modulator | [4] |
| KEGG Pathway | ABC transporters | |||
| cAMP signaling pathway | ||||
| AMPK signaling pathway | ||||
| Gastric acid secretion | ||||
| Pancreatic secretion | ||||
| Bile secretion | ||||
| Vibrio cholerae infection | ||||
| Reactome | ABC-family proteins mediated transport | |||
| WikiPathways | ABC-family proteins mediated transport | |||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 4342). | |||
| REF 2 | Nat Rev Drug Discov. 2013 Feb;12(2):87-90. | |||
| REF 3 | Antibodies and venom peptides: new modalities for ion channels. Nat Rev Drug Discov. 2019 May;18(5):339-357. | |||
| REF 4 | Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015 | |||
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