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TargetIntegrase
LigandBDBM50011133
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1351355 (CHEMBL3266568)
IC50 3100±n/a nM
Citation Fader, LDMalenfant, EParisien, MCarson, RBilodeau, FLandry, SPesant, MBrochu, CMorin, SChabot, CHalmos, TBousquet, YBailey, MDKawai, SHCoulombe, RLaPlante, SJakalian, ABhardwaj, PKWernic, DSchroeder, PAmad, MEdwards, PGarneau, MDuan, JCordingley, MBethell, RMason, SWBös, MBonneau, PPoupart, MAFaucher, AMSimoneau, BFenwick, CYoakim, CTsantrizos, Y Discovery of BI 224436, a Noncatalytic Site Integrase Inhibitor (NCINI) of HIV-1. ACS Med Chem Lett5:422-7 (2014) [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:
BDBM50011133
n/a
NameBDBM50011133
Synonyms:CHEMBL3259892
TypeSmall organic molecule
Emp. Form.C19H15BrClNO3
Mol. Mass.420.684
SMILESCO[C@@H](C(O)=O)c1c(C)nc2ccc(Br)cc2c1-c1ccc(Cl)cc1 |r|
Structure
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