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Assay Detail

CHEMBL856198

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

Binding
Inhibition concentration against HIV-1 protease
8
Total Activities
8
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

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

Publication

Cyclic HIV-1 protease inhibitors derived from mannitol: synthesis, inhibitory potencies, and computational predictions of binding affinities.
Hultén J, Bonham NM, Nillroth U, Hansson T, Zuccarello G, Bouzide A, Aqvist J, Classon B, Danielson UH, Karlén A, Kvarnström I, Samuelsson B, Hallberg A.
J Med Chem (1997) 40 : 885 -897
PubMed 9083477 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 8 6.48 8.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL354502 1 8.00
CHEMBL21145 DMP-323 1 7.82
CHEMBL171148 1 7.10
CHEMBL130998 1 6.70
CHEMBL170517 1 6.70
CHEMBL69731 1 5.40
CHEMBL171235 1 5.10
CHEMBL355782 1 5.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL354502 IC50 = 10.0 nM 8.00
CHEMBL21145 DMP-323 IC50 = 15.0 nM 7.82
CHEMBL171148 IC50 = 80.0 nM 7.10
CHEMBL130998 IC50 = 200.0 nM 6.70
CHEMBL170517 IC50 = 200.0 nM 6.70
CHEMBL69731 IC50 = 4000.0 nM 5.40
CHEMBL171235 IC50 = 8000.0 nM 5.10
CHEMBL355782 IC50 = 10000.0 nM 5.00