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TargetIntegrase
LigandBDBM50021287
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1366289 (CHEMBL3297622)
Kd 24±n/a nM
Citation Fader, LDCarson, RMorin, SBilodeau, FChabot, CHalmos, TBailey, MDKawai, SHCoulombe, RLaplante, SMekhssian, KJakalian, AGarneau, MDuan, JMason, SWSimoneau, BFenwick, CTsantrizos, YYoakim, C Minimizing the Contribution of Enterohepatic Recirculation to Clearance in Rat for the NCINI Class of Inhibitors of HIV. ACS Med Chem Lett5:711-6 (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
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50021287
n/a
NameBDBM50021287
Synonyms:CHEMBL3287920
TypeSmall organic molecule
Emp. Form.C33H34N2O4
Mol. Mass.522.6341
SMILESCc1nc(c(C)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O)-c1ccc(cc1)-c1ccncc1 |r|
Structure
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