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Assay Detail

CHEMBL1675359

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Binding
Inhibition of Human immunodeficiency virus 1 integrase
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Human immunodeficiency virus 1
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Human immunodeficiency virus type 1 integrase (CHEMBL3471)
Type SINGLE PROTEIN
Organism Human immunodeficiency virus 1

Publication

Preclinical evaluation of 1H-benzylindole derivatives as novel human immunodeficiency virus integrase strand transfer inhibitors.
Hombrouck A, Van Remoortel B, Michiels M, Noppe W, Christ F, Eneroth A, Sahlberg BL, Benkestock K, Vrang L, Johansson NG, Barreca ML, De Luca L, Ferro S, Chimirri A, Debyser Z, Witvrouw M.
Antimicrob Agents Chemother (2008) 52 : 2861 -2869
PubMed 18541726 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 6.55 8.64

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL414850 1 8.64
CHEMBL204656 ELVITEGRAVIR 4.0 1 8.42
CHEMBL254316 RALTEGRAVIR 4.0 1 8.05
CHEMBL260185 1 7.22
CHEMBL259011 1 6.96
CHEMBL261541 1 6.72
CHEMBL19977 1 6.70
CHEMBL261714 1 6.57
CHEMBL409643 1 6.52
CHEMBL1673089 1 6.07
CHEMBL260398 1 5.91
CHEMBL260619 1 5.71
CHEMBL406929 1 5.34
CHEMBL405652 1 5.32
CHEMBL263887 1 4.07

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL414850 IC50 = 2.3 nM 8.64
CHEMBL204656 ELVITEGRAVIR IC50 = 3.8 nM 8.42
CHEMBL254316 RALTEGRAVIR IC50 = 9.0 nM 8.05
CHEMBL260185 IC50 = 60.0 nM 7.22
CHEMBL259011 IC50 = 110.0 nM 6.96
CHEMBL261541 IC50 = 190.0 nM 6.72
CHEMBL19977 IC50 = 200.0 nM 6.70
CHEMBL261714 IC50 = 270.0 nM 6.57
CHEMBL409643 IC50 = 300.0 nM 6.52
CHEMBL1673089 IC50 = 860.0 nM 6.07
CHEMBL260398 IC50 = 1240.0 nM 5.91
CHEMBL260619 IC50 = 1960.0 nM 5.71
CHEMBL406929 IC50 = 4600.0 nM 5.34
CHEMBL405652 IC50 = 4760.0 nM 5.32
CHEMBL263887 IC50 = 86080.0 nM 4.07