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Reaction Details
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TargetIntegrase
LigandBDBM50142743
Substrate/Competitorn/a
Meas. Tech.ChEBML_90868
IC50 22000±n/a nM
Citation Costi, RDi Santo, RArtico, MRoux, ARagno, RMassa, STramontano, ELa Colla, MLoddo, RMarongiu, MEPani, ALa Colla, P 6-aryl-2,4-dioxo-5-hexenoic acids, novel integrase inhibitors active against HIV-1 multiplication in cell-based assays. Bioorg Med Chem Lett14:1745-9 (2004) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Integrase
Name:Integrase
Synonyms:Human immunodeficiency virus type 1 integrase
Type:PROTEIN
Mol. Mass.:32231.48
Organism:Human immunodeficiency virus 1
Description:ChEMBL_90865
Residue:288
Sequence:
FLDGIDKAQDEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGI
WQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTIHTDNGSN
FTSTTVKAACWWAGIKQEFGIPYNPQSQGVVESMNKELKKIIGQVRDQAEHLKTAVQMAV
FIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPLWKGPAK
LLWKGEGAVVIQDNSDIKVVPRRKVKIIRDYGKQMAGDDCVASRQDED
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  Blast E-value cutoff:
BDBM50142743
n/a
NameBDBM50142743
Synonyms:(E)-6-[1-(4-Methoxy-benzyl)-1H-pyrrol-2-yl]-2,4-dioxo-hex-5-enoic acid | CHEMBL198366 | CHEMBL46032
TypeSmall organic molecule
Emp. Form.C18H17NO5
Mol. Mass.327.3313
SMILESCOc1ccc(Cn2cccc2C=CC(=O)CC(=O)C(O)=O)cc1 |w:13.14|
Structure
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