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Assay Detail

CHEMBL3871206

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

Binding
Inhibition of recombinant human MIF tautomerase activity expressed in Escherichia coli assessed as borate-enol complex formation using 4-hydroxyphenyl pyruvic acid as substrate preincubated for 20 mins followed by substrate addition measured for 175 sec by fluorescence based analysis
18
Total Activities
18
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Macrophage migration inhibitory factor (CHEMBL2085)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Systematic Study of Effects of Structural Modifications on the Aqueous Solubility of Drug-like Molecules.
Cisneros JA, Robertson MJ, Mercado BQ, Jorgensen WL.
ACS Med Chem Lett (2017) 8 : 124 -127
PubMed 28105287 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 18 6.75 7.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3917143 1 7.85
CHEMBL3918231 1 7.62
CHEMBL3890541 1 7.43
CHEMBL3927658 1 7.41
CHEMBL3899123 1 7.32
CHEMBL3957289 1 7.13
CHEMBL3960793 1 6.84
CHEMBL3906441 1 6.83
CHEMBL3798384 1 6.79
CHEMBL3798149 1 6.70
CHEMBL3924400 1 6.70
CHEMBL3953102 1 6.64
CHEMBL3897449 1 6.58
CHEMBL3943378 1 6.57
CHEMBL3915405 1 6.44
CHEMBL3925522 1 6.28
CHEMBL3945050 1 5.86
CHEMBL3798703 1 4.56

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3917143 Ki = 14.0 nM 7.85
CHEMBL3918231 Ki = 24.0 nM 7.62
CHEMBL3890541 Ki = 37.0 nM 7.43
CHEMBL3927658 Ki = 39.0 nM 7.41
CHEMBL3899123 Ki = 48.0 nM 7.32
CHEMBL3957289 Ki = 74.0 nM 7.13
CHEMBL3960793 Ki = 144.0 nM 6.84
CHEMBL3906441 Ki = 147.0 nM 6.83
CHEMBL3798384 Ki = 161.0 nM 6.79
CHEMBL3798149 Ki = 200.0 nM 6.70
CHEMBL3924400 Ki = 200.0 nM 6.70
CHEMBL3953102 Ki = 230.0 nM 6.64
CHEMBL3897449 Ki = 260.0 nM 6.58
CHEMBL3943378 Ki = 270.0 nM 6.57
CHEMBL3915405 Ki = 360.0 nM 6.44
CHEMBL3925522 Ki = 530.0 nM 6.28
CHEMBL3945050 Ki = 1370.0 nM 5.86
CHEMBL3798703 Ki = 27300.0 nM 4.56