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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:nelfinavir
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Accession:CHEBI:7496 term browser browse the term
Definition:An aryl sulfide that is used (as its mesylate salt) for treatment of HIV and also exhibits some anticancer properties.
Synonyms:exact_synonym: (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylsulfanyl)butyl]decahydroisoquinoline-3-carboxamide
 related_synonym: Formula=C32H45N3O4S;   InChI=1S/C32H45N3O4S/c1-21-25(15-10-16-28(21)36)30(38)33-26(20-40-24-13-6-5-7-14-24)29(37)19-35-18-23-12-9-8-11-22(23)17-27(35)31(39)34-32(2,3)4/h5-7,10,13-16,22-23,26-27,29,36-37H,8-9,11-12,17-20H2,1-4H3,(H,33,38)(H,34,39)/t22-,23+,26-,27-,29+/m0/s1;   InChIKey=QAGYKUNXZHXKMR-HKWSIXNMSA-N;   SMILES=Cc1c(O)cccc1C(=O)N[C@@H](CSc1ccccc1)[C@H](O)CN1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)NC(C)(C)C
 xref: CAS:159989-64-7;   DrugBank:DB00220;   Drug_Central:1893;   HMDB:HMDB0014365;   KEGG:C07257;   KEGG:D08259;   LINCS:LSM-5819
 xref_mesh: MESH:D019888
 xref: PDBeChem:1UN;   PMID:23109184;   PMID:23386514;   PMID:23454896;   PMID:23647753;   PMID:23872785;   PMID:23916134;   PMID:24194293;   PMID:24418752;   PMID:24483157;   PMID:24498124;   PMID:24574416;   PMID:24596143;   PMID:24719428;   Reaxys:7419619;   Wikipedia:Nelfinavir
 cyclic_relationship: is_conjugate_base_of CHEBI:78767

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nelfinavir term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Abcb11 ATP binding cassette subfamily B member 11 decreases activity
multiple interactions		 ISO Nelfinavir results in decreased activity of ABCB11 protein
Nelfinavir inhibits the reaction [ABCB11 protein results in increased transport of Taurocholic Acid]		 CTD PMID:20829430, PMID:23956101, PMID:24014644 NCBI chr 3:55,480,024...55,587,946
Ensembl chr 3:55,480,024...55,587,946 		JBrowse link
G Abcb1a ATP binding cassette subfamily B member 1A affects response to substance
affects transport		 ISO ABCB1 gene SNP affects the susceptibility to Nelfinavir; ABCB1 intron SNP affects the susceptibility to Nelfinavir
ABCB1 protein affects the transport of Nelfinavir		 CTD PMID:16041239 NCBI chr 4:22,339,829...22,517,642
Ensembl chr 4:22,133,521...22,425,515 		JBrowse link
G Abcc1 ATP binding cassette subfamily C member 1 affects transport ISO ABCC1 protein affects the transport of Nelfinavir CTD PMID:16041239 NCBI chr10:549,537...672,235
Ensembl chr10:549,883...672,196 		JBrowse link
G Abcc2 ATP binding cassette subfamily C member 2 affects transport ISO ABCC2 protein affects the transport of Nelfinavir CTD PMID:16041239 NCBI chr 1:263,554,426...263,612,556
Ensembl chr 1:263,554,453...263,613,252 		JBrowse link
G Abcg2 ATP binding cassette subfamily G member 2 multiple interactions
decreases activity		 ISO Nelfinavir inhibits the reaction [ABCG2 protein results in increased export of abacavir]; Nelfinavir inhibits the reaction [ABCG2 protein results in increased export of Imatinib Mesylate]; Nelfinavir inhibits the reaction [ABCG2 protein results in increased export of Zidovudine]
Nelfinavir results in decreased activity of ABCG2 protein		 CTD PMID:16041239, PMID:19056916 NCBI chr 4:88,765,441...88,890,268
Ensembl chr 4:88,832,178...88,890,621 		JBrowse link
G Adipoq adiponectin, C1Q and collagen domain containing decreases expression
multiple interactions		 ISO Nelfinavir results in decreased expression of ADIPOQ mRNA; Nelfinavir results in decreased expression of ADIPOQ protein
rosiglitazone inhibits the reaction [Nelfinavir results in decreased secretion of ADIPOQ protein]
diphenyleneiodonium inhibits the reaction [Nelfinavir results in decreased expression of ADIPOQ protein]		 CTD PMID:15865214, PMID:17668557 NCBI chr11:81,330,845...81,344,488
Ensembl chr11:81,330,293...81,344,488 		JBrowse link
G Aifm1 apoptosis inducing factor, mitochondria associated 1 decreases secretion
decreases transport
affects localization		 ISO Nelfinavir results in decreased secretion of AIFM1 protein
Nelfinavir results in decreased transport of AIFM1 protein
Nelfinavir affects the localization of AIFM1 protein		 CTD PMID:18497877 NCBI chr  X:135,304,063...135,343,062
Ensembl chr  X:135,304,066...135,343,087 		JBrowse link
G Alb albumin affects binding ISO Nelfinavir binds to ALB protein CTD PMID:15814459, PMID:16336266 NCBI chr14:19,176,275...19,191,793
Ensembl chr14:19,176,277...19,191,863 		JBrowse link
G Atf3 activating transcription factor 3 increases expression ISO Nelfinavir results in increased expression of ATF3; Nelfinavir results in increased expression of ATF3 mRNA CTD PMID:21762082, PMID:22935518 NCBI chr13:109,817,892...109,849,632
Ensembl chr13:109,817,728...109,849,632 		JBrowse link
G Atf4 activating transcription factor 4 increases expression ISO Nelfinavir results in increased expression of ATF4 protein CTD PMID:22935518 NCBI chr 7:121,480,723...121,482,781
Ensembl chr 7:121,480,723...121,482,772 		JBrowse link
G Atf6 activating transcription factor 6 multiple interactions
affects localization
increases stability
decreases expression
decreases cleavage		 ISO Nelfinavir inhibits the reaction [MBTPS2 protein results in increased cleavage of and results in increased activity of ATF6 protein]
Nelfinavir affects the localization of ATF6 protein
Nelfinavir results in increased stability of ATF6 protein
Nelfinavir results in decreased expression of ATF6 protein alternative form
Nelfinavir results in decreased cleavage of ATF6 protein		 CTD PMID:21355074 NCBI chr13:89,053,457...89,242,531
Ensembl chr13:89,055,983...89,242,443 		JBrowse link
G Casp3 caspase 3 increases activity ISO Nelfinavir results in increased activity of CASP3 protein CTD PMID:20105315 NCBI chr16:48,845,011...48,863,249
Ensembl chr16:48,845,012...48,863,204 		JBrowse link
G Casp7 caspase 7 increases activity ISO Nelfinavir results in increased activity of CASP7 protein CTD PMID:20105315 NCBI chr 1:277,190,557...277,242,779
Ensembl chr 1:277,190,964...277,242,774 		JBrowse link
G Casp8 caspase 8 increases activity ISO Nelfinavir results in increased activity of CASP8 protein CTD PMID:20105315 NCBI chr 9:65,614,142...65,662,624
Ensembl chr 9:65,614,142...65,662,106 		JBrowse link
G Casp9 caspase 9 decreases activity ISO Nelfinavir results in decreased activity of CASP9 protein CTD PMID:18497877 NCBI chr 5:160,356,211...160,373,774
Ensembl chr 5:160,355,833...160,373,778 		JBrowse link
G Ccl2 C-C motif chemokine ligand 2 increases expression
multiple interactions		 ISO Nelfinavir results in increased expression of CCL2 protein
diphenyleneiodonium inhibits the reaction [Nelfinavir results in increased expression of CCL2 protein]		 CTD PMID:17668557 NCBI chr10:69,412,065...69,413,863
Ensembl chr10:69,412,017...69,413,870 		JBrowse link
G Ccl3 C-C motif chemokine ligand 3 increases expression ISO Nelfinavir results in increased expression of CCL3 protein CTD PMID:17668557 NCBI chr10:70,869,516...70,871,066
Ensembl chr10:70,869,513...70,871,066 		JBrowse link
G Ccnd3 cyclin D3 decreases expression ISO Nelfinavir results in decreased expression of CCND3 protein CTD PMID:19106637 NCBI chr 9:15,404,816...15,410,905
Ensembl chr 9:15,404,822...15,410,943 		JBrowse link
G Cdc25a cell division cycle 25A multiple interactions
increases degradation		 ISO [Nelfinavir results in increased degradation of CDC25A protein] which results in decreased activity of CDK2 protein CTD PMID:17283158 NCBI chr 8:117,953,223...117,971,552
Ensembl chr 8:117,953,444...117,971,519 		JBrowse link
G Cdk2 cyclin dependent kinase 2 multiple interactions
decreases activity		 ISO [Nelfinavir results in increased degradation of CDC25A protein] which results in decreased activity of CDK2 protein
Nelfinavir results in decreased activity of CDK2 protein		 CTD PMID:17283158 NCBI chr 7:3,124,953...3,132,533
Ensembl chr 7:3,124,954...3,132,457 		JBrowse link
G Cycs cytochrome c, somatic decreases secretion ISO Nelfinavir results in decreased secretion of CYCS protein CTD PMID:18497877 NCBI chr 4:80,331,226...80,333,326
Ensembl chr 4:80,331,227...80,333,326 		JBrowse link
G Cyp1a1 cytochrome P450, family 1, subfamily a, polypeptide 1 increases expression ISO Nelfinavir results in increased expression of CYP1A1 mRNA CTD PMID:9860486 NCBI chr 8:62,472,087...62,478,122
Ensembl chr 8:62,472,095...62,478,147 		JBrowse link
G Cyp3a23-3a1 cytochrome P450, family 3, subfamily a, polypeptide 23-polypeptide 1 increases expression EXP Nelfinavir results in increased expression of CYP3A23-3A1 mRNA CTD PMID:16408618 NCBI chr12:11,053,888...11,082,742
Ensembl chr12:11,655,402...11,733,136 		JBrowse link
G Cyp3a9 cytochrome P450, family 3, subfamily a, polypeptide 9 decreases activity ISO Nelfinavir results in decreased activity of CYP3A5 protein CTD PMID:15523003 NCBI chr12:19,074,288...19,114,491
Ensembl chr12:19,074,583...19,114,399 		JBrowse link
G Ddit3 DNA-damage inducible transcript 3 increases expression ISO Nelfinavir results in increased expression of DDIT3 mRNA CTD PMID:22935518 NCBI chr 7:70,578,564...70,585,074
Ensembl chr 7:70,580,198...70,585,084 		JBrowse link
G Eif2a eukaryotic translation initiation factor 2A increases phosphorylation ISO Nelfinavir results in increased phosphorylation of EIF2A protein CTD PMID:19106637 NCBI chr 2:148,722,343...148,755,781
Ensembl chr 2:148,722,231...148,755,520 		JBrowse link
G Fasn fatty acid synthase decreases expression ISO Nelfinavir results in decreased expression of FASN mRNA; Nelfinavir results in decreased expression of FASN protein CTD PMID:21355074 NCBI chr10:109,987,735...110,005,901
Ensembl chr10:109,987,735...110,005,901 		JBrowse link
G Hmox1 heme oxygenase 1 increases expression
multiple interactions		 ISO Nelfinavir results in increased expression of HMOX1
Ascorbic Acid inhibits the reaction [Nelfinavir results in increased expression of HMOX1]		 CTD PMID:15577407 NCBI chr19:14,508,634...14,515,455
Ensembl chr19:14,508,616...14,515,456 		JBrowse link
G Hspa5 heat shock protein family A (Hsp70) member 5 increases expression
multiple interactions		 ISO Nelfinavir results in increased expression of HSPA5; Nelfinavir results in increased expression of HSPA5 protein
Tamoxifen promotes the reaction [Nelfinavir results in increased expression of HSPA5 protein]		 CTD PMID:19106637, PMID:20594311, PMID:21355074, PMID:21762082 NCBI chr 3:13,838,304...13,842,763
Ensembl chr 3:13,838,304...13,842,762 		JBrowse link
G Il1b interleukin 1 beta increases expression ISO Nelfinavir results in increased expression of IL1B protein CTD PMID:17668557 NCBI chr 3:121,876,256...121,882,637
Ensembl chr 3:121,876,263...121,882,726 		JBrowse link
G Il6 interleukin 6 multiple interactions
increases expression		 ISO diphenyleneiodonium inhibits the reaction [Nelfinavir results in increased expression of IL6 protein]; Nelfinavir inhibits the reaction [Lipopolysaccharides results in increased expression of IL6 mRNA]
rosiglitazone inhibits the reaction [Nelfinavir results in increased expression of IL6 mRNA]
Nelfinavir results in increased expression of IL6 mRNA; Nelfinavir results in increased expression of IL6 protein		 CTD PMID:15388451, PMID:15865214, PMID:17668557 NCBI chr 4:3,043,231...3,047,807
Ensembl chr 4:3,043,231...3,047,807 		JBrowse link
G Inhbe inhibin subunit beta E increases expression ISO Nelfinavir results in increased expression of INHBE mRNA CTD PMID:22935518 NCBI chr 7:70,641,423...70,642,848
Ensembl chr 7:70,640,075...70,643,169 		JBrowse link
G Lep leptin multiple interactions
decreases secretion
decreases expression		 ISO diphenyleneiodonium inhibits the reaction [Nelfinavir results in decreased expression of LEP protein]
Nelfinavir results in decreased secretion of LEP protein		 CTD PMID:17668557, PMID:19033543 NCBI chr 4:56,337,695...56,351,818
Ensembl chr 4:56,337,695...56,351,818 		JBrowse link
G Lpl lipoprotein lipase multiple interactions
decreases expression		 ISO [Stavudine co-treated with Lamivudine co-treated with Nelfinavir] results in decreased expression of LPL mRNA
Nelfinavir results in decreased expression of LPL mRNA		 CTD PMID:11741158 NCBI chr16:22,537,687...22,561,487
Ensembl chr16:22,537,056...22,561,496 		JBrowse link
G Map1lc3b microtubule-associated protein 1 light chain 3 beta multiple interactions
increases expression		 ISO Tamoxifen promotes the reaction [Nelfinavir results in increased expression of MAP1LC3B protein] CTD PMID:20594311 NCBI chr19:53,635,449...53,643,970
Ensembl chr19:53,629,779...53,646,058 		JBrowse link
G Mbtps2 membrane-bound transcription factor peptidase, site 2 multiple interactions ISO Nelfinavir inhibits the reaction [MBTPS2 protein results in increased cleavage of and results in increased activity of ATF6 protein]; Nelfinavir inhibits the reaction [MBTPS2 protein results in increased cleavage of and results in increased activity of SREBF1 protein] CTD PMID:21355074 NCBI chr  X:40,258,933...40,309,047
Ensembl chr  X:40,258,493...40,310,563 		JBrowse link
G Mcl1 MCL1 apoptosis regulator, BCL2 family member increases expression ISO Nelfinavir results in increased expression of MCL1 protein CTD PMID:20105315 NCBI chr 2:197,786,212...197,788,992 JBrowse link
G Me1 malic enzyme 1 decreases expression
multiple interactions		 ISO Nelfinavir results in decreased expression of ME1 mRNA
[Stavudine co-treated with Lamivudine co-treated with Nelfinavir] results in decreased expression of ME1 mRNA		 CTD PMID:11741158 NCBI chr 8:94,256,830...94,368,834
Ensembl chr 8:94,256,839...94,368,834 		JBrowse link
G Nr1i2 nuclear receptor subfamily 1, group I, member 2 multiple interactions ISO NR1I2 gene promotes the reaction [Rifampin results in increased metabolism of Nelfinavir] CTD PMID:18799805 NCBI chr11:65,022,100...65,058,546
Ensembl chr11:65,022,100...65,058,545 		JBrowse link
G Pcna proliferating cell nuclear antigen decreases expression ISO Nelfinavir results in decreased expression of PCNA protein CTD PMID:19106637 NCBI chr 3:124,880,698...124,884,570
Ensembl chr 3:124,880,698...124,884,570 		JBrowse link
G Plin1 perilipin 1 multiple interactions
increases degradation
decreases expression		 ISO Ammonium Chloride inhibits the reaction [Nelfinavir results in increased degradation of PLIN1 protein]; leupeptin inhibits the reaction [Nelfinavir results in increased degradation of PLIN1 protein]
Nelfinavir results in decreased expression of PLIN1 protein		 CTD PMID:17488708 NCBI chr 1:141,458,907...141,470,927
Ensembl chr 1:141,458,181...141,471,010 		JBrowse link
G Rb1 RB transcriptional corepressor 1 decreases phosphorylation ISO Nelfinavir results in decreased phosphorylation of RB protein CTD PMID:17283158 NCBI chr15:55,081,582...55,209,060
Ensembl chr15:55,083,140...55,209,342 		JBrowse link
G Srebf1 sterol regulatory element binding transcription factor 1 decreases cleavage
increases expression
increases stability
decreases expression
affects localization
multiple interactions		 ISO Nelfinavir results in decreased cleavage of SREBF1 protein
Nelfinavir results in increased expression of SREBF1 protein
Nelfinavir results in increased stability of SREBF1 protein
Nelfinavir results in decreased expression of SREBF1 protein alternative form
Nelfinavir affects the localization of SREBF1 protein
Nelfinavir inhibits the reaction [MBTPS2 protein results in increased cleavage of and results in increased activity of SREBF1 protein]		 CTD PMID:16940799, PMID:21355074 NCBI chr10:46,570,996...46,593,021
Ensembl chr10:46,570,996...46,593,009 		JBrowse link
G Tnf tumor necrosis factor multiple interactions
increases expression		 ISO Nelfinavir inhibits the reaction [Lipopolysaccharides results in increased secretion of TNF protein]
rosiglitazone inhibits the reaction [Nelfinavir results in increased expression of TNF mRNA]
Nelfinavir results in increased expression of TNF mRNA; Nelfinavir results in increased expression of TNF protein		 CTD PMID:15388451, PMID:15865214, PMID:17668557 NCBI chr20:5,189,382...5,192,000
Ensembl chr20:5,189,390...5,192,000 		JBrowse link
G Ugt2b17 UDP glucuronosyltransferase family 2 member B17 increases expression EXP Nelfinavir results in increased expression of UGT2B1 mRNA CTD PMID:16408618 NCBI chr14:22,724,399...22,736,148
Ensembl chr14:22,724,070...22,825,444 		JBrowse link
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  CHEBI ontology 19816
    role 19764
      application 19426
        pharmaceutical 19301
          drug 19301
            antineoplastic agent 17001
              nelfinavir 45
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  CHEBI ontology 19816
    subatomic particle 19814
      composite particle 19814
        hadron 19814
          baryon 19814
            nucleon 19814
              atomic nucleus 19814
                atom 19814
                  main group element atom 19702
                    p-block element atom 19702
                      carbon group element atom 19608
                        carbon atom 19597
                          organic molecular entity 19597
                            organic group 18537
                              organic divalent group 18530
                                organodiyl group 18530
                                  carbonyl group 18436
                                    carbonyl compound 18436
                                      carboxylic acid 18114
                                        carboacyl group 17372
                                          univalent carboacyl group 17372
                                            carbamoyl group 17158
                                              carboxamide 17158
                                                monocarboxylic acid amide 14569
                                                  arenecarboxamide 6511
                                                    benzamides 6511
                                                      nelfinavir 45
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