Drug Information
Drug General Information | |||||
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Drug ID |
D0WI3T
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Former ID |
DAP000171
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Drug Name |
Saquinavir
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Synonyms |
Fortovase; Invirase; ROC; SQV; Saguinavir; Ro 318959; Fortovase (TN); Fortovase(TM); Invirase (TN); Ro 31-8959; Invirase(TM)(monomesylate); Ro-31-8959; Saquinavir (JAN/USP/INN); QNC-ASN-HPH-DIQ-NTB; CIS-N-TERT-BUTYL-DECAHYDRO-2-[2(R)-HYDROXY-4-PHENYL-3(S)-[[N-2-QUINOLYLCARBONYL-L-ASPARAGINYL]AMINO]BUTYL]-(4AS)-ISOQUINOLINE-3(S)-CARBOXAMIDE; (2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide; (2s)-N-[(2s,3r)-4-[(2s,3s,4as,8as)-3-(Tert-Butylcarbamoyl)-3,4,4a,5,6,7,8,8a-Octahydro-1h-Isoquinolin-2-Yl]-3-Hydroxy-1-Phenyl-Butan-2-Yl]-2-(Quinolin-2-Ylcarbonylamino)butanediamide
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Drug Type |
Small molecular drug
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Therapeutic Class |
Anti-HIV Agents
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Company |
Hoffmann-La Roche pharmaceutical company
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Structure |
Download2D MOL |
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Formula |
C38H50N6O5
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InChI |
InChI=1S/C38H50N6O5/c1-38(2,3)43-37(49)32-20-26-14-7-8-15-27(26)22-44(32)23-33(45)30(19-24-11-5-4-6-12-24)41-36(48)31(21-34(39)46)42-35(47)29-18-17-25-13-9-10-16-28(25)40-29/h4-6,9-13,16-18,26-27,30-33,45H,7-8,14-15,19-23H2,1-3H3,(H2,39,46)(H,41,48)(H,42,47)(H,43,49)/t26-,27+,30-,31-,32-,33+/m0/s1
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InChIKey |
QWAXKHKRTORLEM-UGJKXSETSA-N
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CAS Number |
CAS 127779-20-8
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PubChem Compound ID | |||||
PubChem Substance ID |
596481, 830611, 838962, 7847495, 7890157, 7890295, 7980558, 8030420, 10298771, 11467142, 11468262, 11486850, 14790389, 14912870, 24424137, 24424140, 24424146, 24424150, 26706895, 36885127, 46392170, 46394116, 46394117, 47720800, 47869868, 48169598, 48243608, 49666064, 49699303, 49743129, 49743137, 49746604, 50070617, 50105601, 53790242, 56320473, 57403600, 74519778, 85177047, 85788913, 92715215, 93166481, 93167028, 93617413, 93617549, 99453891, 103179606, 104624996, 104829254, 117695825
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SuperDrug ATC ID |
J05AE01
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SuperDrug CAS ID |
cas=127779208
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Target and Pathway | |||||
Target(s) | HIV protease | Target Info | Inhibitor | [536954] | |
References | |||||
Ref 468045 | (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: 4813). | ||||
Ref 550326 | Approved antiretroviral drugs. Antiretroviral Drugs. Company report of AVERT. 2009. |
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