Skip to main content
Free research Free research Free assay review with research home and workspace preview
Quick search ChEMBL 36
Assay Detail

CHEMBL5161145

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

Binding
Inhibition of bacterially expressed GST-Xa-tagged human AAK1 using 5-FAM-labelled Aha-KEEQSQITSQVTGQIGWR-NH2 peptide as substrate incubated for 3 hrs in presence of ATP by electrophoretic analysis
ChEMBL ↗
55
Total Activities
55
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

AP2-associated protein kinase 1 (CHEMBL3830) ↗
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and Optimization of Biaryl Alkyl Ethers as a Novel Class of Highly Selective, CNS-Penetrable, and Orally Active Adaptor Protein-2-Associated Kinase 1 (AAK1) Inhibitors for the Potential Treatment of Neuropathic Pain.
Luo G, Chen L, Kostich WA, Hamman B, Allen J, Easton A, Bourin C, Gulianello M, Lippy J, Nara S, Pattipati SN, Dandapani K, Dokania M, Vattikundala P, Sharma V, Elavazhagan S, Verma MK, Lal Das M, Wagh S, Balakrishnan A, Johnson BM, Santone KS, Thalody G, Denton R, Saminathan H, Holenarsipur VK, Kumar A, Rao A, Putlur SP, Sarvasiddhi SK, Shankar G, Louis JV, Ramarao M, Conway CM, Li YW, Pieschl R, Tian Y, Hong Y, Bristow L, Albright CF, Bronson JJ, Macor JE, Dzierba CD.
J Med Chem (2022) 65 : 4534 -4564
PubMed 35261239 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 55 8.79 9.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4534648 — — 1 9.52
CHEMBL5178261 — — 1 9.52
CHEMBL5188433 — — 1 9.40
CHEMBL5183016 — — 1 9.40
CHEMBL5178245 — — 1 9.40
CHEMBL5204210 — — 1 9.40
CHEMBL4062388 — — 1 9.40
CHEMBL5185616 — — 1 9.40
CHEMBL4084103 — — 1 9.40
CHEMBL5187778 — — 1 9.30
CHEMBL5174967 — — 1 9.30
CHEMBL5202370 — — 1 9.30
CHEMBL5186783 — — 1 9.30
CHEMBL5205578 — — 1 9.30
CHEMBL5179172 — — 1 9.30
CHEMBL4092824 — — 1 9.30
CHEMBL5202896 — — 1 9.22
CHEMBL5189920 — — 1 9.22
CHEMBL5204340 — — 1 9.22
CHEMBL5177574 — — 1 9.10
CHEMBL5194667 — — 1 9.10
CHEMBL5202142 — — 1 9.10
CHEMBL5179243 — — 1 9.10
CHEMBL5189987 — — 1 9.10
CHEMBL5198877 — — 1 9.10
CHEMBL5184381 — — 1 9.05
CHEMBL5185000 — — 1 9.00
CHEMBL5170576 — — 1 8.96
CHEMBL5177255 — — 1 8.96
CHEMBL5177318 — — 1 8.96

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4534648 — IC50 = 0.3 nM 9.52
CHEMBL5178261 — IC50 = 0.3 nM 9.52
CHEMBL5183016 — IC50 = 0.4 nM 9.40
CHEMBL5178245 — IC50 = 0.4 nM 9.40
CHEMBL5204210 — IC50 = 0.4 nM 9.40
CHEMBL4062388 — IC50 = 0.4 nM 9.40
CHEMBL5185616 — IC50 = 0.4 nM 9.40
CHEMBL4084103 — IC50 = 0.4 nM 9.40
CHEMBL5188433 — IC50 = 0.4 nM 9.40
CHEMBL5174967 — IC50 = 0.5 nM 9.30
CHEMBL5187778 — IC50 = 0.5 nM 9.30
CHEMBL5202370 — IC50 = 0.5 nM 9.30
CHEMBL4092824 — IC50 = 0.5 nM 9.30
CHEMBL5186783 — IC50 = 0.5 nM 9.30
CHEMBL5205578 — IC50 = 0.5 nM 9.30
CHEMBL5179172 — IC50 = 0.5 nM 9.30
CHEMBL5202896 — IC50 = 0.6 nM 9.22
CHEMBL5189920 — IC50 = 0.6 nM 9.22
CHEMBL5204340 — IC50 = 0.6 nM 9.22
CHEMBL5198877 — IC50 = 0.8 nM 9.10
CHEMBL5189987 — IC50 = 0.8 nM 9.10
CHEMBL5177574 — IC50 = 0.8 nM 9.10
CHEMBL5179243 — IC50 = 0.8 nM 9.10
CHEMBL5202142 — IC50 = 0.8 nM 9.10
CHEMBL5194667 — IC50 = 0.8 nM 9.10
CHEMBL5184381 — IC50 = 0.9 nM 9.05
CHEMBL5185000 — IC50 = 1.0 nM 9.00
CHEMBL5170576 — IC50 = 1.1 nM 8.96
CHEMBL5177255 — IC50 = 1.1 nM 8.96
CHEMBL5177318 — IC50 = 1.1 nM 8.96
CHEMBL5205319 — IC50 = 1.2 nM 8.92
CHEMBL5177360 — IC50 = 1.2 nM 8.92
CHEMBL5199698 — IC50 = 1.2 nM 8.92
CHEMBL5189450 — IC50 = 1.3 nM 8.89
CHEMBL5194195 — IC50 = 1.4 nM 8.85
CHEMBL5195653 — IC50 = 1.7 nM 8.77
CHEMBL5089410 PILAVAPADIN IC50 = 2.0 nM 8.70
CHEMBL5204513 — IC50 = 2.1 nM 8.68
CHEMBL5175327 — IC50 = 2.3 nM 8.64
CHEMBL5198578 — IC50 = 2.6 nM 8.59
CHEMBL4073745 — IC50 = 3.0 nM 8.52
CHEMBL5175427 — IC50 = 3.5 nM 8.46
CHEMBL5171363 — IC50 = 3.8 nM 8.42
CHEMBL5180992 — IC50 = 4.5 nM 8.35
CHEMBL5195859 — IC50 = 4.5 nM 8.35
CHEMBL5193012 — IC50 = 4.6 nM 8.34
CHEMBL5172656 — IC50 = 5.0 nM 8.30
CHEMBL5191442 — IC50 = 10.0 nM 8.00
CHEMBL4872886 — IC50 = 12.0 nM 7.92
CHEMBL5180606 — IC50 = 19.0 nM 7.72