Investigation of the pharmacophore space of Severe Acute Respiratory Syndrome coronavirus (SARS-CoV) NTPase/helicase by dihydroxychromone derivatives.
Identifieur interne : 002A86 ( Main/Exploration ); précédent : 002A85; suivant : 002A87Investigation of the pharmacophore space of Severe Acute Respiratory Syndrome coronavirus (SARS-CoV) NTPase/helicase by dihydroxychromone derivatives.
Auteurs : Chaewoon Lee [Corée du Sud] ; Jin Moo Lee ; Na-Ra Lee ; Dong-Eun Kim ; Yong-Joo Jeong ; Youhoon ChongSource :
- Bioorganic & medicinal chemistry letters [ 1464-3405 ] ; 2009.
Descripteurs français
- KwdFr :
- 4H-1-Benzopyran-4-ones (), 4H-1-Benzopyran-4-ones (pharmacologie), 4H-1-Benzopyran-4-ones (synthèse chimique), Antienzymes (), Antienzymes (pharmacologie), Antienzymes (synthèse chimique), Antiviraux (), Antiviraux (pharmacologie), Antiviraux (synthèse chimique), Catéchols (), Helicase (antagonistes et inhibiteurs), Helicase (métabolisme), Relation structure-activité, Virus du SRAS (enzymologie).
- MESH :
- antagonistes et inhibiteurs : Helicase.
- enzymologie : Virus du SRAS.
- métabolisme : Helicase.
- pharmacologie : 4H-1-Benzopyran-4-ones, Antienzymes, Antiviraux.
- synthèse chimique : 4H-1-Benzopyran-4-ones, Antienzymes, Antiviraux.
- 4H-1-Benzopyran-4-ones, Antienzymes, Antiviraux, Catéchols, Relation structure-activité.
English descriptors
- KwdEn :
- Antiviral Agents (chemical synthesis), Antiviral Agents (chemistry), Antiviral Agents (pharmacology), Catechols (chemistry), Chromones (chemical synthesis), Chromones (chemistry), Chromones (pharmacology), DNA Helicases (antagonists & inhibitors), DNA Helicases (metabolism), Enzyme Inhibitors (chemical synthesis), Enzyme Inhibitors (chemistry), Enzyme Inhibitors (pharmacology), SARS Virus (enzymology), Structure-Activity Relationship.
- MESH :
- chemical , antagonists & inhibitors : DNA Helicases.
- chemical , chemical synthesis : Antiviral Agents, Chromones, Enzyme Inhibitors.
- chemical , chemistry : Antiviral Agents, Catechols, Chromones, Enzyme Inhibitors.
- chemical , metabolism : DNA Helicases.
- chemical , pharmacology : Antiviral Agents, Chromones, Enzyme Inhibitors.
- enzymology : SARS Virus.
- Structure-Activity Relationship.
Abstract
Aryl diketoacids have been identified as the first SARS-CoV NTPase/helicase inhibitors with a distinct pharmacophore featuring an arylmethyl group attached to a diketoacid. In order to search for the pharmacophore space around the diketoacid core, three classes of dihydroxychromone derivatives were prepared. Based on SAR study, an extended feature of the pharmacophore model of SARS-CoV NTPase/helicase was proposed which is constituted of a diketoacid core, a hydrophobic arylmethyl substituent, and a free catechol unit.
DOI: 10.1016/j.bmcl.2009.07.009
PubMed: 19625187
Affiliations:
Links toward previous steps (curation, corpus...)
- to stream PubMed, to step Corpus: 001862
- to stream PubMed, to step Curation: 001862
- to stream PubMed, to step Checkpoint: 001848
- to stream Ncbi, to step Merge: 001F66
- to stream Ncbi, to step Curation: 001F66
- to stream Ncbi, to step Checkpoint: 001F66
- to stream Main, to step Merge: 002B35
- to stream Main, to step Curation: 002A86
Le document en format XML
<record><TEI><teiHeader><fileDesc><titleStmt><title xml:lang="en">Investigation of the pharmacophore space of Severe Acute Respiratory Syndrome coronavirus (SARS-CoV) NTPase/helicase by dihydroxychromone derivatives.</title><author><name sortKey="Lee, Chaewoon" sort="Lee, Chaewoon" uniqKey="Lee C" first="Chaewoon" last="Lee">Chaewoon Lee</name><affiliation wicri:level="1"><nlm:affiliation>Department of Bioscience & Biotechnology, Konkuk University, Seoul 143-701, Republic of Korea.</nlm:affiliation><country xml:lang="fr">Corée du Sud</country><wicri:regionArea>Department of Bioscience & Biotechnology, Konkuk University, Seoul 143-701</wicri:regionArea><placeName><settlement type="city">Séoul</settlement><region type="capital">Région capitale de Séoul</region></placeName></affiliation></author><author><name sortKey="Lee, Jin Moo" sort="Lee, Jin Moo" uniqKey="Lee J" first="Jin Moo" last="Lee">Jin Moo Lee</name></author><author><name sortKey="Lee, Na Ra" sort="Lee, Na Ra" uniqKey="Lee N" first="Na-Ra" last="Lee">Na-Ra Lee</name></author><author><name sortKey="Kim, Dong Eun" sort="Kim, Dong Eun" uniqKey="Kim D" first="Dong-Eun" last="Kim">Dong-Eun Kim</name></author><author><name sortKey="Jeong, Yong Joo" sort="Jeong, Yong Joo" uniqKey="Jeong Y" first="Yong-Joo" last="Jeong">Yong-Joo Jeong</name></author><author><name sortKey="Chong, Youhoon" sort="Chong, Youhoon" uniqKey="Chong Y" first="Youhoon" last="Chong">Youhoon Chong</name></author></titleStmt><publicationStmt><idno type="wicri:source">PubMed</idno><date when="2009">2009</date><idno type="RBID">pubmed:19625187</idno><idno type="pmid">19625187</idno><idno type="doi">10.1016/j.bmcl.2009.07.009</idno><idno type="wicri:Area/PubMed/Corpus">001862</idno><idno type="wicri:explorRef" wicri:stream="PubMed" wicri:step="Corpus" wicri:corpus="PubMed">001862</idno><idno type="wicri:Area/PubMed/Curation">001862</idno><idno type="wicri:explorRef" wicri:stream="PubMed" wicri:step="Curation">001862</idno><idno type="wicri:Area/PubMed/Checkpoint">001848</idno><idno type="wicri:explorRef" wicri:stream="Checkpoint" wicri:step="PubMed">001848</idno><idno type="wicri:Area/Ncbi/Merge">001F66</idno><idno type="wicri:Area/Ncbi/Curation">001F66</idno><idno type="wicri:Area/Ncbi/Checkpoint">001F66</idno><idno type="wicri:Area/Main/Merge">002B35</idno><idno type="wicri:Area/Main/Curation">002A86</idno><idno type="wicri:Area/Main/Exploration">002A86</idno></publicationStmt><sourceDesc><biblStruct><analytic><title xml:lang="en">Investigation of the pharmacophore space of Severe Acute Respiratory Syndrome coronavirus (SARS-CoV) NTPase/helicase by dihydroxychromone derivatives.</title><author><name sortKey="Lee, Chaewoon" sort="Lee, Chaewoon" uniqKey="Lee C" first="Chaewoon" last="Lee">Chaewoon Lee</name><affiliation wicri:level="1"><nlm:affiliation>Department of Bioscience & Biotechnology, Konkuk University, Seoul 143-701, Republic of Korea.</nlm:affiliation><country xml:lang="fr">Corée du Sud</country><wicri:regionArea>Department of Bioscience & Biotechnology, Konkuk University, Seoul 143-701</wicri:regionArea><placeName><settlement type="city">Séoul</settlement><region type="capital">Région capitale de Séoul</region></placeName></affiliation></author><author><name sortKey="Lee, Jin Moo" sort="Lee, Jin Moo" uniqKey="Lee J" first="Jin Moo" last="Lee">Jin Moo Lee</name></author><author><name sortKey="Lee, Na Ra" sort="Lee, Na Ra" uniqKey="Lee N" first="Na-Ra" last="Lee">Na-Ra Lee</name></author><author><name sortKey="Kim, Dong Eun" sort="Kim, Dong Eun" uniqKey="Kim D" first="Dong-Eun" last="Kim">Dong-Eun Kim</name></author><author><name sortKey="Jeong, Yong Joo" sort="Jeong, Yong Joo" uniqKey="Jeong Y" first="Yong-Joo" last="Jeong">Yong-Joo Jeong</name></author><author><name sortKey="Chong, Youhoon" sort="Chong, Youhoon" uniqKey="Chong Y" first="Youhoon" last="Chong">Youhoon Chong</name></author></analytic><series><title level="j">Bioorganic & medicinal chemistry letters</title><idno type="eISSN">1464-3405</idno><imprint><date when="2009" type="published">2009</date></imprint></series></biblStruct></sourceDesc></fileDesc><profileDesc><textClass><keywords scheme="KwdEn" xml:lang="en"><term>Antiviral Agents (chemical synthesis)</term><term>Antiviral Agents (chemistry)</term><term>Antiviral Agents (pharmacology)</term><term>Catechols (chemistry)</term><term>Chromones (chemical synthesis)</term><term>Chromones (chemistry)</term><term>Chromones (pharmacology)</term><term>DNA Helicases (antagonists & inhibitors)</term><term>DNA Helicases (metabolism)</term><term>Enzyme Inhibitors (chemical synthesis)</term><term>Enzyme Inhibitors (chemistry)</term><term>Enzyme Inhibitors (pharmacology)</term><term>SARS Virus (enzymology)</term><term>Structure-Activity Relationship</term></keywords><keywords scheme="KwdFr" xml:lang="fr"><term>4H-1-Benzopyran-4-ones ()</term><term>4H-1-Benzopyran-4-ones (pharmacologie)</term><term>4H-1-Benzopyran-4-ones (synthèse chimique)</term><term>Antienzymes ()</term><term>Antienzymes (pharmacologie)</term><term>Antienzymes (synthèse chimique)</term><term>Antiviraux ()</term><term>Antiviraux (pharmacologie)</term><term>Antiviraux (synthèse chimique)</term><term>Catéchols ()</term><term>Helicase (antagonistes et inhibiteurs)</term><term>Helicase (métabolisme)</term><term>Relation structure-activité</term><term>Virus du SRAS (enzymologie)</term></keywords><keywords scheme="MESH" type="chemical" qualifier="antagonists & inhibitors" xml:lang="en"><term>DNA Helicases</term></keywords><keywords scheme="MESH" type="chemical" qualifier="chemical synthesis" xml:lang="en"><term>Antiviral Agents</term><term>Chromones</term><term>Enzyme Inhibitors</term></keywords><keywords scheme="MESH" type="chemical" qualifier="chemistry" xml:lang="en"><term>Antiviral Agents</term><term>Catechols</term><term>Chromones</term><term>Enzyme Inhibitors</term></keywords><keywords scheme="MESH" type="chemical" qualifier="metabolism" xml:lang="en"><term>DNA Helicases</term></keywords><keywords scheme="MESH" type="chemical" qualifier="pharmacology" xml:lang="en"><term>Antiviral Agents</term><term>Chromones</term><term>Enzyme Inhibitors</term></keywords><keywords scheme="MESH" qualifier="antagonistes et inhibiteurs" xml:lang="fr"><term>Helicase</term></keywords><keywords scheme="MESH" qualifier="enzymologie" xml:lang="fr"><term>Virus du SRAS</term></keywords><keywords scheme="MESH" qualifier="enzymology" xml:lang="en"><term>SARS Virus</term></keywords><keywords scheme="MESH" qualifier="métabolisme" xml:lang="fr"><term>Helicase</term></keywords><keywords scheme="MESH" qualifier="pharmacologie" xml:lang="fr"><term>4H-1-Benzopyran-4-ones</term><term>Antienzymes</term><term>Antiviraux</term></keywords><keywords scheme="MESH" qualifier="synthèse chimique" xml:lang="fr"><term>4H-1-Benzopyran-4-ones</term><term>Antienzymes</term><term>Antiviraux</term></keywords><keywords scheme="MESH" xml:lang="en"><term>Structure-Activity Relationship</term></keywords><keywords scheme="MESH" xml:lang="fr"><term>4H-1-Benzopyran-4-ones</term><term>Antienzymes</term><term>Antiviraux</term><term>Catéchols</term><term>Relation structure-activité</term></keywords></textClass></profileDesc></teiHeader><front><div type="abstract" xml:lang="en">Aryl diketoacids have been identified as the first SARS-CoV NTPase/helicase inhibitors with a distinct pharmacophore featuring an arylmethyl group attached to a diketoacid. In order to search for the pharmacophore space around the diketoacid core, three classes of dihydroxychromone derivatives were prepared. Based on SAR study, an extended feature of the pharmacophore model of SARS-CoV NTPase/helicase was proposed which is constituted of a diketoacid core, a hydrophobic arylmethyl substituent, and a free catechol unit.</div></front></TEI><affiliations><list><country><li>Corée du Sud</li></country><region><li>Région capitale de Séoul</li></region><settlement><li>Séoul</li></settlement></list><tree><noCountry><name sortKey="Chong, Youhoon" sort="Chong, Youhoon" uniqKey="Chong Y" first="Youhoon" last="Chong">Youhoon Chong</name><name sortKey="Jeong, Yong Joo" sort="Jeong, Yong Joo" uniqKey="Jeong Y" first="Yong-Joo" last="Jeong">Yong-Joo Jeong</name><name sortKey="Kim, Dong Eun" sort="Kim, Dong Eun" uniqKey="Kim D" first="Dong-Eun" last="Kim">Dong-Eun Kim</name><name sortKey="Lee, Jin Moo" sort="Lee, Jin Moo" uniqKey="Lee J" first="Jin Moo" last="Lee">Jin Moo Lee</name><name sortKey="Lee, Na Ra" sort="Lee, Na Ra" uniqKey="Lee N" first="Na-Ra" last="Lee">Na-Ra Lee</name></noCountry><country name="Corée du Sud"><region name="Région capitale de Séoul"><name sortKey="Lee, Chaewoon" sort="Lee, Chaewoon" uniqKey="Lee C" first="Chaewoon" last="Lee">Chaewoon Lee</name></region></country></tree></affiliations></record>Pour manipuler ce document sous Unix (Dilib)
EXPLOR_STEP=$WICRI_ROOT/Sante/explor/SrasV1/Data/Main/Exploration
HfdSelect -h $EXPLOR_STEP/biblio.hfd -nk 002A86 | SxmlIndent | more
Ou
HfdSelect -h $EXPLOR_AREA/Data/Main/Exploration/biblio.hfd -nk 002A86 | SxmlIndent | more
Pour mettre un lien sur cette page dans le réseau Wicri
{{Explor lien
|wiki= Sante
|area= SrasV1
|flux= Main
|étape= Exploration
|type= RBID
|clé= pubmed:19625187
|texte= Investigation of the pharmacophore space of Severe Acute Respiratory Syndrome coronavirus (SARS-CoV) NTPase/helicase by dihydroxychromone derivatives.
}}
Pour générer des pages wiki
HfdIndexSelect -h $EXPLOR_AREA/Data/Main/Exploration/RBID.i -Sk "pubmed:19625187" \
| HfdSelect -Kh $EXPLOR_AREA/Data/Main/Exploration/biblio.hfd \
| NlmPubMed2Wicri -a SrasV1
| This area was generated with Dilib version V0.6.33. |  |