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Assay Detail

CHEMBL821387

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

Binding
Dissociation constant obtained by inhibition of Wild-type protease
4
Total Activities
4
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

Identification of MK-944a: a second clinical candidate from the hydroxylaminepentanamide isostere series of HIV protease inhibitors.
Dorsey BD, McDonough C, McDaniel SL, Levin RB, Newton CL, Hoffman JM, Darke PL, Zugay-Murphy JA, Emini EA, Schleif WA, Olsen DB, Stahlhut MW, Rutkowski CA, Kuo LC, Lin JH, Chen IW, Michelson SR, Holloway MK, Huff JR, Vacca JP.
J Med Chem (2000) 43 : 3386 -3399
PubMed 10978186 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 4 9.97 10.21

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL114 SAQUINAVIR 4.0 1 10.21
CHEMBL163 RITONAVIR 4.0 1 10.21
CHEMBL584 NELFINAVIR 4.0 1 9.85
CHEMBL5483011 INDINAVIR 3.0 1 9.62

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL114 SAQUINAVIR Ki = 0.062 nM 10.21
CHEMBL163 RITONAVIR Ki = 0.062 nM 10.21
CHEMBL584 NELFINAVIR Ki = 0.14 nM 9.85
CHEMBL5483011 INDINAVIR Ki = 0.24 nM 9.62