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Assay Detail

CHEMBL764924

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Binding affinity against HIV protease
25
Total Activities
25
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 Expert

Target

Human immunodeficiency virus type 1 protease (CHEMBL243)
Type SINGLE PROTEIN
Organism Human immunodeficiency virus 1

Publication

Design, synthesis, and evaluation of tetrahydropyrimidinones as an example of a general approach to nonpeptide HIV protease inhibitors.
De Lucca GV, Liang J, Aldrich PE, Calabrese J, Cordova B, Klabe RM, Rayner MM, Chang CH.
J Med Chem (1997) 40 : 1707 -1719
PubMed 9171880 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 25 7.93 10.74

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL284942 1 10.74
CHEMBL284340 1 10.06
CHEMBL284136 1 9.92
CHEMBL286390 1 9.60
CHEMBL289762 1 9.52
CHEMBL285871 1 9.31
CHEMBL289907 1 8.85
CHEMBL297493 1 8.82
CHEMBL36862 1 8.77
CHEMBL49870 1 8.70
CHEMBL298253 1 8.60
CHEMBL36725 1 8.42
CHEMBL285282 1 8.31
CHEMBL39592 1 8.10
CHEMBL38339 1 7.96
CHEMBL39749 1 7.82
CHEMBL37118 1 7.48
CHEMBL297187 1 7.40
CHEMBL49823 1 6.26
CHEMBL298120 1 6.11
CHEMBL36481 1 6.01
CHEMBL296549 1 5.71
CHEMBL443260 1 5.48
CHEMBL297133 1 5.32
CHEMBL296111 1 5.10

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL284942 Ki = 0.018 nM 10.74
CHEMBL284340 Ki = 0.088 nM 10.06
CHEMBL284136 Ki = 0.12 nM 9.92
CHEMBL286390 Ki = 0.25 nM 9.60
CHEMBL289762 Ki = 0.3 nM 9.52
CHEMBL285871 Ki = 0.49 nM 9.31
CHEMBL289907 Ki = 1.4 nM 8.85
CHEMBL297493 Ki = 1.5 nM 8.82
CHEMBL36862 Ki = 1.7 nM 8.77
CHEMBL49870 Ki = 2.0 nM 8.70
CHEMBL298253 Ki = 2.5 nM 8.60
CHEMBL36725 Ki = 3.8 nM 8.42
CHEMBL285282 Ki = 4.9 nM 8.31
CHEMBL39592 Ki = 8.0 nM 8.10
CHEMBL38339 Ki = 11.0 nM 7.96
CHEMBL39749 Ki = 15.0 nM 7.82
CHEMBL37118 Ki = 33.0 nM 7.48
CHEMBL297187 Ki = 40.0 nM 7.40
CHEMBL49823 Ki = 550.0 nM 6.26
CHEMBL298120 Ki = 780.0 nM 6.11
CHEMBL36481 Ki = 970.0 nM 6.01
CHEMBL296549 Ki = 1970.0 nM 5.71
CHEMBL443260 Ki = 3300.0 nM 5.48
CHEMBL297133 Ki = 4800.0 nM 5.32
CHEMBL296111 Ki = 8000.0 nM 5.10