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Assay Detail

CHEMBL4433162

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

Binding
Inhibition of recombinant full length human C-terminal His-tagged autotaxin expressed in human 293E cells assessed as choline release using lysophosphatidylcholine as substrate after 1 hr by Amplex red fluorescence assay
14
Total Activities
14
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

Autotaxin (CHEMBL3691)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Novel Autotaxin Inhibitors for the Treatment of Osteoarthritis Pain: Lead Optimization via Structure-Based Drug Design.
Jones SB, Pfeifer LA, Bleisch TJ, Beauchamp TJ, Durbin JD, Klimkowski VJ, Hughes NE, Rito CJ, Dao Y, Gruber JM, Bui H, Chambers MG, Chandrasekhar S, Lin C, McCann DJ, Mudra DR, Oskins JL, Swearingen CA, Thirunavukkarasu K, Norman BH.
ACS Med Chem Lett (2016) 7 : 857 -861
PubMed 27660691 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 7.81 8.66

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4453084 1 8.66
CHEMBL4549771 1 8.60
CHEMBL4476558 1 8.55
CHEMBL4569141 1 8.40
CHEMBL4454442 1 8.32
CHEMBL3186509 1 8.08
CHEMBL4462537 1 8.00
CHEMBL4472840 1 7.70
CHEMBL4446322 1 7.62
CHEMBL4458386 1 7.28
CHEMBL4561467 1 7.10
CHEMBL4456849 1 6.91
CHEMBL4588676 1 6.28
CHEMBL4448598 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4453084 IC50 = 2.2 nM 8.66
CHEMBL4549771 IC50 = 2.5 nM 8.60
CHEMBL4476558 IC50 = 2.8 nM 8.55
CHEMBL4569141 IC50 = 4.0 nM 8.40
CHEMBL4454442 IC50 = 4.8 nM 8.32
CHEMBL3186509 IC50 = 8.4 nM 8.08
CHEMBL4462537 IC50 = 10.0 nM 8.00
CHEMBL4472840 IC50 = 19.8 nM 7.70
CHEMBL4446322 IC50 = 24.0 nM 7.62
CHEMBL4458386 IC50 = 52.3 nM 7.28
CHEMBL4561467 IC50 = 79.0 nM 7.10
CHEMBL4456849 IC50 = 123.0 nM 6.91
CHEMBL4588676 IC50 = 520.0 nM 6.28
CHEMBL4448598 IC50 < 1.7 nM -