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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 3:54,016,854...54,112,797
Ensembl chr 3:54,017,127...54,112,730
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 4:25,357,467...25,529,941
Ensembl chr 4:25,158,362...25,442,709
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 chr10:528,961...655,179
Ensembl chr10:531,812...655,114
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 1:242,664,657...242,723,239
Ensembl chr 1:242,664,657...242,723,238
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 4:87,676,241...87,802,757
Ensembl chr 4:87,745,319...87,802,409
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 chr11:77,721,912...77,735,644
Ensembl chr11:77,721,912...77,735,564
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:127,650,223...127,689,356
Ensembl chr  X:127,650,226...127,689,256
JBrowse link
G Alb albumin affects binding ISO Nelfinavir binds to ALB protein CTD PMID:15814459 PMID:16336266 NCBI chr14:17,607,397...17,622,814
Ensembl chr14:17,607,381...17,622,836
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 chr13:102,751,278...102,800,520
Ensembl chr13:102,751,321...102,764,631
JBrowse link
G Atf4 activating transcription factor 4 increases expression ISO Nelfinavir results in increased expression of ATF4 protein CTD PMID:22935518 NCBI chr 7:111,804,135...111,806,457
Ensembl chr 7:111,804,183...111,806,446
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 chr13:82,927,579...83,106,381
Ensembl chr13:82,930,034...83,107,177
JBrowse link
G Casp3 caspase 3 increases activity ISO Nelfinavir results in increased activity of CASP3 protein CTD PMID:20105315 NCBI chr16:45,662,910...45,681,171
Ensembl chr16:45,662,910...45,684,648
JBrowse link
G Casp7 caspase 7 increases activity ISO Nelfinavir results in increased activity of CASP7 protein CTD PMID:20105315 NCBI chr 1:255,437,195...255,476,737
Ensembl chr 1:255,437,172...255,476,729
JBrowse link
G Casp8 caspase 8 increases activity ISO Nelfinavir results in increased activity of CASP8 protein CTD PMID:20105315 NCBI chr 9:60,263,863...60,312,542
Ensembl chr 9:60,264,075...60,312,542
JBrowse link
G Casp9 caspase 9 decreases activity ISO Nelfinavir results in decreased activity of CASP9 protein CTD PMID:18497877 NCBI chr 5:154,108,872...154,126,628
Ensembl chr 5:154,109,046...154,126,626
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 chr10:67,005,424...67,007,222
Ensembl chr10:67,005,424...67,007,226
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 chr10:68,451,388...68,452,938
Ensembl chr10:68,451,388...68,452,938
JBrowse link
G Ccnd3 cyclin D3 decreases expression ISO Nelfinavir results in decreased expression of CCND3 protein CTD PMID:19106637 NCBI chr 9:13,394,161...13,400,341
Ensembl chr 9:13,394,169...13,489,371
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 8:109,864,356...109,882,734
Ensembl chr 8:109,864,478...109,882,701
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 7:1,129,878...1,137,431
Ensembl chr 7:1,129,811...1,137,403
JBrowse link
G Cycs cytochrome c, somatic decreases secretion ISO Nelfinavir results in decreased secretion of CYCS protein CTD PMID:18497877 NCBI chr 4:79,651,894...79,653,994
Ensembl chr 4:79,651,378...79,654,054
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 8:58,096,021...58,102,130
Ensembl chr 8:58,096,077...58,102,125
JBrowse link
G Cyp3a2 cytochrome P450, family 3, subfamily a, polypeptide 2 decreases activity ISO Nelfinavir results in decreased activity of CYP3A4 protein CTD PMID:15523003 NCBI chr12:9,207,986...9,230,038
Ensembl chr12:9,015,383...9,285,008
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 chr12:9,256,159...9,285,020
Ensembl chr12:9,254,475...9,285,030
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 chr12:16,806,222...16,846,428
Ensembl chr12:16,806,207...16,846,422
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 7:63,115,645...63,121,203
Ensembl chr 7:63,116,380...63,121,201
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 2:142,761,303...142,794,767
Ensembl chr 2:142,761,416...142,795,068
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 chr10:106,072,093...106,090,259
Ensembl chr10:106,072,091...106,090,261
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 chr19:13,466,287...13,474,082
Ensembl chr19:13,467,244...13,474,079
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 3:18,055,507...18,059,969
Ensembl chr 3:18,055,405...18,059,891
JBrowse link
G Il1b interleukin 1 beta increases expression ISO Nelfinavir results in increased expression of IL1B protein CTD PMID:17668557 NCBI chr 3:116,577,005...116,583,386
Ensembl chr 3:116,577,010...116,583,415
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 4:5,214,602...5,219,178
Ensembl chr 4:5,213,394...5,219,178
JBrowse link
G Inhbe inhibin subunit beta E increases expression ISO Nelfinavir results in increased expression of INHBE mRNA CTD PMID:22935518 NCBI chr 7:63,177,558...63,178,983
Ensembl chr 7:63,176,219...63,179,172
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 4:57,661,127...57,675,262
Ensembl chr 4:57,661,131...57,675,262
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 chr16:20,830,055...20,853,855
Ensembl chr16:20,829,465...20,855,249
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 chr19:49,665,795...49,673,655
Ensembl chr19:49,665,791...49,677,690
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:37,410,914...37,461,130
Ensembl chr  X:37,410,811...37,464,430
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 2:183,219,137...183,235,676
Ensembl chr 2:183,219,220...183,222,303
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 8:87,549,043...87,660,251
Ensembl chr 8:87,549,043...87,660,304
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 chr11:62,460,213...62,496,665
Ensembl chr11:62,460,213...62,496,658
JBrowse link
G Pcna proliferating cell nuclear antigen decreases expression ISO Nelfinavir results in decreased expression of PCNA protein CTD PMID:19106637 NCBI chr 3:119,499,039...119,502,911
Ensembl chr 3:119,498,810...119,502,995
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 1:133,664,294...133,676,854
Ensembl chr 1:133,664,892...133,676,828
JBrowse link
G Rb1 RB transcriptional corepressor 1 decreases phosphorylation ISO Nelfinavir results in decreased phosphorylation of RB protein CTD PMID:17283158 NCBI chr15:48,371,295...48,502,473
Ensembl chr15:48,371,296...48,502,302
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 chr10:45,007,637...45,029,650
Ensembl chr10:45,007,637...45,029,650
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 chr20:3,622,011...3,624,629
Ensembl chr20:3,622,011...3,624,629
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 chr14:21,024,035...21,035,784
Ensembl chr14:21,024,006...21,035,986
JBrowse link

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                            organic group 18728
                              organic divalent group 18719
                                organodiyl group 18719
                                  carbonyl group 18667
                                    carbonyl compound 18667
                                      carboxylic acid 18364
                                        carboacyl group 17482
                                          univalent carboacyl group 17482
                                            carbamoyl group 17298
                                              carboxamide 17298
                                                monocarboxylic acid amide 15014
                                                  arenecarboxamide 7265
                                                    benzamides 7265
                                                      nelfinavir 46
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