ONTOLOGY REPORT - ANNOTATIONS

Term:saquinavir
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Accession:CHEBI:63621 term browser browse the term
Definition:An aspartic acid derivative obtained by formal condensation of the primary amino group of (2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl]-3-hydroxy-1-phenylbutan-2-ylamine with the carboxy group of N(2)(-quinolin-2-ylcarbonyl)-L-asparagine. An inhibitor of HIV-1 protease.
Synonyms:exact_synonym: N(1)-{(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl]-3-hydroxy-1-phenylbutan-2-yl}-N(2)-(quinolin-2-ylcarbonyl)-L-aspartamide
 related_synonym: C38H50N6O5;   Fortovase;   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;   InChIKey=QWAXKHKRTORLEM-UGJKXSETSA-N;   [H][C@@]12CCCC[C@]1([H])CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc3ccccc3n1)[C@@H](C2)C(=O)NC(C)(C)C
 alt_id: CHEBI:9028
 xref_casrn: 127779-20-8
 xref: ChemIDplus:127779-20-8 "CAS Registry Number";   CiteXplore:21135186 "PubMed citation";   CiteXplore:21600016 "PubMed citation";   CiteXplore:21683096 "PubMed citation";   CiteXplore:21819645 "PubMed citation";   CiteXplore:21819804 "PubMed citation";   CiteXplore:22024400 "PubMed citation";   CiteXplore:22104402 "PubMed citation";   CiteXplore:22136805 "PubMed citation";   CiteXplore:22150669 "PubMed citation";   CiteXplore:22159894 "PubMed citation";   DrugBank:DB01232 "DrugBank";   KEGG DRUG:127779-20-8 "CAS Registry Number";   KEGG DRUG:D00429 "KEGG DRUG"
 xref_mesh: MESH:D019258
 xref: Patent:EP432695 "Patent";   Patent:US5196438 "Patent";   Reaxys:5469491 "Reaxys Registry Number";   Wikipedia:Saquinavir "Wikipedia"

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saquinavir term browser
Symbol Object Name GBrowse Qualifiers Evidence Chr Start Stop Reference Source
G Abcb11 ATP-binding cassette, subfamily B (MDR/TAP), member 11 decreases activity ISO RGD:6480464 CTD
G Abcb1a ATP-binding cassette, sub-family B (MDR/TAP), member 1A GBrowse link affects export ISO 4 21,709,855 21,796,628 RGD:6480464 CTD
G Abcb1a ATP-binding cassette, sub-family B (MDR/TAP), member 1A GBrowse link increases export ISO 4 21,709,855 21,796,628 RGD:6480464 CTD
G Abcc1 ATP-binding cassette, subfamily C (CFTR/MRP), member 1 GBrowse link increases export ISO 10 452,239 575,705 RGD:6480464 CTD
G Abcc2 ATP-binding cassette, subfamily C (CFTR/MRP), member 2 affects export ISO RGD:6480464 CTD
G Abcc2 ATP-binding cassette, subfamily C (CFTR/MRP), member 2 increases export ISO RGD:6480464 CTD
G Abcc2 ATP-binding cassette, subfamily C (CFTR/MRP), member 2 multiple interactions ISO RGD:6480464 CTD
G Abcc2 ATP-binding cassette, subfamily C (CFTR/MRP), member 2 increases export ISO RGD:6480464 CTD
G Adipoq adiponectin, C1Q and collagen domain containing GBrowse link decreases expression ISO 11 79,908,291 79,911,065 RGD:6480464 CTD
G Adipoq adiponectin, C1Q and collagen domain containing GBrowse link multiple interactions ISO 11 79,908,291 79,911,065 RGD:6480464 CTD
G Adipoq adiponectin, C1Q and collagen domain containing GBrowse link multiple interactions ISO 11 79,908,291 79,911,065 RGD:6480464 CTD
G Aebp1 AE binding protein 1 GBrowse link multiple interactions ISO 14 86,525,748 86,535,664 RGD:6480464 CTD
G Alb albumin GBrowse link affects binding ISO 14 19,126,935 19,142,214 RGD:6480464 CTD
G Alb albumin GBrowse link affects binding ISO 14 19,126,935 19,142,214 RGD:6480464 CTD
G Alox5ap arachidonate 5-lipoxygenase activating protein GBrowse link multiple interactions ISO 12 6,245,808 6,269,796 RGD:6480464 CTD
G Arpp21 cAMP-regulated phosphoprotein 21 GBrowse link multiple interactions ISO 8 116,674,803 116,794,799 RGD:6480464 CTD
G Asic2 acid-sensing (proton-gated) ion channel 2 GBrowse link multiple interactions ISO 10 69,103,244 70,190,305 RGD:6480464 CTD
G Atf6 activating transcription factor 6 GBrowse link increases expression ISO 13 86,543,773 86,718,970 RGD:6480464 CTD
G C1r complement component 1, r subcomponent GBrowse link multiple interactions ISO 4 160,712,582 160,729,362 RGD:6480464 CTD
G C3ar1 complement component 3a receptor 1 GBrowse link multiple interactions ISO 4 159,326,402 159,333,433 RGD:6480464 CTD
G Casp9 caspase 9, apoptosis-related cysteine peptidase GBrowse link increases cleavage ISO 5 160,704,234 160,721,796 RGD:6480464 CTD
G Ccrn4l CCR4 carbon catabolite repression 4-like (S. cerevisiae) GBrowse link multiple interactions ISO 2 140,120,310 140,140,518 RGD:6480464 CTD
G Cd36 CD36 molecule (thrombospondin receptor) GBrowse link multiple interactions ISO 4 13,471,878 13,525,620 RGD:6480464 CTD
G Cfd complement factor D (adipsin) GBrowse link multiple interactions ISO 7 11,325,538 11,327,261 RGD:6480464 CTD
G Cidec cell death-inducing DFFA-like effector c GBrowse link multiple interactions ISO 4 149,307,986 149,321,303 RGD:6480464 CTD
G Clcn3 chloride channel, voltage-sensitive 3 GBrowse link multiple interactions ISO 16 32,447,259 32,518,533 RGD:6480464 CTD
G Cybb cytochrome b-245, beta polypeptide GBrowse link multiple interactions ISO X 25,514,572 25,547,181 RGD:6480464 CTD
G Cyp1a1 cytochrome P450, family 1, subfamily a, polypeptide 1 GBrowse link increases expression ISO 8 61,462,207 61,468,237 RGD:6480464 CTD
G Cyp3a2 cytochrome P450, family 3, subfamily a, polypeptide 2 GBrowse link multiple interactions ISO 12 9,517,016 9,541,000 RGD:6480464 CTD
G Cyp3a2 cytochrome P450, family 3, subfamily a, polypeptide 2 GBrowse link decreases activity ISO 12 9,517,016 9,541,000 RGD:6480464 CTD
G Dcn decorin GBrowse link multiple interactions ISO 7 35,004,234 35,045,191 RGD:6480464 CTD
G Dusp3 dual specificity phosphatase 3 GBrowse link multiple interactions ISO 10 91,031,206 91,044,858 RGD:6480464 CTD
G Elovl3 ELOVL fatty acid elongase 3 GBrowse link multiple interactions ISO 1 251,351,908 251,355,736 RGD:6480464 CTD
G Esr2 estrogen receptor 2 (ER beta) GBrowse link multiple interactions ISO 6 98,691,167 98,775,299 RGD:6480464 CTD
G Etv6 ets variant 6 GBrowse link multiple interactions ISO 4 170,909,412 171,150,381 RGD:6480464 CTD
G Fads2 fatty acid desaturase 2 GBrowse link multiple interactions ISO 1 212,512,691 212,542,622 RGD:6480464 CTD
G Faim Fas apoptotic inhibitory molecule GBrowse link multiple interactions ISO 8 9,522,803 9,539,269 RGD:6480464 CTD
G G0s2 G0/G1switch 2 GBrowse link multiple interactions ISO 13 109,121,297 109,122,209 RGD:6480464 CTD
G Ganc glucosidase, alpha; neutral C GBrowse link multiple interactions ISO 3 106,892,422 106,944,283 RGD:6480464 CTD
G Gucy1b3 guanylate cyclase 1, soluble, beta 3 GBrowse link multiple interactions ISO 2 173,683,153 173,735,298 RGD:6480464 CTD
G Hadh hydroxyacyl-CoA dehydrogenase GBrowse link multiple interactions ISO 2 228,698,545 228,751,691 RGD:6480464 CTD
G Hcn1 hyperpolarization-activated cyclic nucleotide-gated potassium channel 1 GBrowse link multiple interactions ISO 2 49,525,949 49,939,066 RGD:6480464 CTD
G Hspa5 heat shock protein 5 GBrowse link increases expression ISO 3 13,783,825 13,788,022 RGD:6480464 CTD
G Ikzf4 IKAROS family zinc finger 4 GBrowse link multiple interactions ISO 7 1,928,510 1,948,712 RGD:6480464 CTD
G Il6 interleukin 6 GBrowse link increases expression ISO 4 456,799 461,376 RGD:6480464 CTD
G Il6 interleukin 6 GBrowse link multiple interactions ISO 4 456,799 461,376 RGD:6480464 CTD
G Il6 interleukin 6 GBrowse link multiple interactions ISO 4 456,799 461,376 RGD:6480464 CTD
G Ins2 insulin 2 GBrowse link multiple interactions ISO 1 202,935,548 202,936,379 RGD:6480464 CTD
G Klhl28 kelch-like family member 28 GBrowse link multiple interactions ISO 6 86,281,944 86,314,935 RGD:6480464 CTD
G Lamc2 laminin, gamma 2 GBrowse link multiple interactions ISO 13 68,151,074 68,211,117 RGD:6480464 CTD
G Lef1 lymphoid enhancer binding factor 1 GBrowse link multiple interactions ISO 2 228,550,263 228,673,131 RGD:6480464 CTD
G Lep leptin GBrowse link multiple interactions ISO 4 55,943,837 55,945,938 RGD:6480464 CTD
G Lpl lipoprotein lipase GBrowse link decreases activity ISO 16 22,533,105 22,556,905 RGD:6480464 CTD
G Lpl lipoprotein lipase GBrowse link decreases expression ISO 16 22,533,105 22,556,905 RGD:6480464 CTD
G Ly6i lymphocyte antigen 6 complex, locus I GBrowse link multiple interactions ISO 7 113,306,011 113,310,996 RGD:6480464 CTD
G Me1 malic enzyme 1, NADP(+)-dependent, cytosolic GBrowse link decreases expression ISO 8 91,839,845 91,955,917 RGD:6480464 CTD
G Mgat4c mannosyl (alpha-1,3-)-glycoprotein beta-1,4-N-acetylglucosaminyltransferase, isozyme C (putative) GBrowse link multiple interactions ISO 7 40,171,454 40,383,441 RGD:6480464 CTD
G Mrap melanocortin 2 receptor accessory protein GBrowse link multiple interactions ISO 11 30,720,783 30,731,275 RGD:6480464 CTD
G Myod1 myogenic differentiation 1 GBrowse link multiple interactions ISO 1 96,910,190 96,912,900 RGD:6480464 CTD
G Nap1l5 nucleosome assembly protein 1-like 5 GBrowse link multiple interactions ISO 4 87,796,429 87,798,296 RGD:6480464 CTD
G Notch4 notch 4 GBrowse link multiple interactions EXP 20 4,263,205 4,287,312 RGD:6480464 CTD
G Notch4 notch 4 GBrowse link decreases expression EXP 20 4,263,205 4,287,312 RGD:6480464 CTD
G Nup210 nucleoporin 210 GBrowse link multiple interactions ISO 4 125,189,612 125,285,493 RGD:6480464 CTD
G Oaz3 ornithine decarboxylase antizyme 3 GBrowse link multiple interactions ISO 2 189,408,566 189,411,500 RGD:6480464 CTD
G Pfkfb3 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase 3 GBrowse link multiple interactions ISO 17 78,241,182 78,268,272 RGD:6480464 CTD
G Phf6 PHD finger protein 6 GBrowse link multiple interactions ISO X 139,850,136 139,890,670 RGD:6480464 CTD
G Pidd p53-induced death domain protein GBrowse link multiple interactions ISO 1 201,626,042 201,631,182 RGD:6480464 CTD
G Piwil2 piwi-like RNA-mediated gene silencing 2 GBrowse link multiple interactions ISO 15 50,757,820 50,823,943 RGD:6480464 CTD
G Pou5f1 POU class 5 homeobox 1 multiple interactions ISO RGD:6480464 CTD
G Prdm1 PR domain containing 1, with ZNF domain GBrowse link multiple interactions ISO 20 48,438,224 48,459,848 RGD:6480464 CTD
G Prl2c1 Prolactin family 2, subfamily c, member 1 GBrowse link multiple interactions ISO 17 43,420,887 43,429,208 RGD:6480464 CTD
G Reep6 receptor accessory protein 6 GBrowse link multiple interactions ISO 7 10,885,266 10,891,936 RGD:6480464 CTD
G Rnf151 ring finger protein 151 GBrowse link multiple interactions ISO 10 13,970,717 13,973,034 RGD:6480464 CTD
G Rpain RPA interacting protein GBrowse link multiple interactions ISO 10 57,874,557 57,881,526 RGD:6480464 CTD
G S100a8 S100 calcium binding protein A8 GBrowse link multiple interactions ISO 2 182,961,994 182,962,513 RGD:6480464 CTD
G Slco1a2 solute carrier organic anion transporter family, member 1A2 GBrowse link affects uptake ISO 4 179,790,209 179,851,288 RGD:6480464 CTD
G Slco1a4 solute carrier organic anion transporter family, member 1a4 affects uptake ISO RGD:6480464 CTD
G Sod2 superoxide dismutase 2, mitochondrial GBrowse link multiple interactions ISO 1 41,862,997 41,870,327 RGD:6480464 CTD
G Spink5 serine peptidase inhibitor, Kazal type 5 GBrowse link multiple interactions ISO 18 37,563,911 37,631,579 RGD:6480464 CTD
G Sval2 seminal vesicle antigen-like 2 GBrowse link multiple interactions ISO 4 69,666,108 69,670,072 RGD:6480464 CTD
G Timp2 TIMP metallopeptidase inhibitor 2 GBrowse link multiple interactions ISO 10 108,310,473 108,358,821 RGD:6480464 CTD
G Tjp1 tight junction protein 1 GBrowse link multiple interactions EXP 1 119,684,774 119,750,532 RGD:6480464 CTD
G Tjp1 tight junction protein 1 GBrowse link decreases expression EXP 1 119,684,774 119,750,532 RGD:6480464 CTD
G Tnf tumor necrosis factor GBrowse link multiple interactions ISO 20 3,661,000 3,663,618 RGD:6480464 CTD
G Tnf tumor necrosis factor GBrowse link multiple interactions ISO 20 3,661,000 3,663,618 RGD:6480464 CTD
G Tnf tumor necrosis factor GBrowse link increases expression ISO 20 3,661,000 3,663,618 RGD:6480464 CTD
G Trim42 tripartite motif-containing 42 multiple interactions ISO RGD:6480464 CTD
G Wnt10a wingless-type MMTV integration site family, member 10A GBrowse link multiple interactions ISO 9 74,124,403 74,137,508 RGD:6480464 CTD
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Term Annotations click to browse term
  CHEBI ontology 501881
    role 491510
      biological role 489686
        antimicrobial agent 46038
          antiviral agent 4033
            antiviral drug 2459
              saquinavir 88
Path 2
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  CHEBI ontology 501881
    subatomic particle 500845
      composite particle 500845
        hadron 500845
          baryon 500845
            nucleon 500845
              atomic nucleus 500845
                atom 500845
                  main group element atom 470301
                    p-block element atom 467779
                      carbon group element atom 419149
                        carbon atom 415667
                          organic molecular entity 415660
                            organic group 171184
                              organic divalent group 169999
                                organodiyl group 169999
                                  carbonyl group 169689
                                    carbonyl compound 169689
                                      carboxylic acid 122651
                                        amino acid 50207
                                          modified amino acid 8623
                                            aspartic acid derivative 88
                                              saquinavir 88
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