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Assay Detail

CHEMBL2390550

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

Binding
Inhibition of recombinant JAK1 (unknown origin) using Val-Ala-Leu-Val-Asp-Gly-Tyr-Phe-Arg-Leu-Thr-Thr as substrate after 30 mins in presence of ATP
34
Total Activities
34
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

Tyrosine-protein kinase JAK1 (CHEMBL2835)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Identification of C-2 hydroxyethyl imidazopyrrolopyridines as potent JAK1 inhibitors with favorable physicochemical properties and high selectivity over JAK2.
Zak M, Hurley CA, Ward SI, Bergeron P, Barrett K, Balazs M, Blair WS, Bull R, Chakravarty P, Chang C, Crackett P, Deshmukh G, DeVoss J, Dragovich PS, Eigenbrot C, Ellwood C, Gaines S, Ghilardi N, Gibbons P, Gradl S, Gribling P, Hamman C, Harstad E, Hewitt P, Johnson A, Johnson T, Kenny JR, Koehler MF, Bir Kohli P, Labadie S, Lee WP, Liao J, Liimatta M, Mendonca R, Narukulla R, Pulk R, Reeve A, Savage S, Shia S, Steffek M, Ubhayakar S, van Abbema A, Aliagas I, Avitabile-Woo B, Xiao Y, Yang J, Kulagowski JJ.
J Med Chem (2013) 56 : 4764 -4785
PubMed 23659214 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 34 8.45 10.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2386635 1 10.00
CHEMBL2386636 1 9.52
CHEMBL221959 TOFACITINIB 4.0 1 9.15
CHEMBL2386640 1 9.10
CHEMBL2386629 1 9.10
CHEMBL2386634 1 9.05
CHEMBL2386637 1 8.96
CHEMBL2386630 1 8.96
CHEMBL2386632 1 8.92
CHEMBL2159198 1 8.89
CHEMBL2386645 1 8.80
CHEMBL2386643 1 8.74
CHEMBL2386633 1 8.72
CHEMBL2386648 1 8.70
CHEMBL2385096 1 8.70
CHEMBL2386646 1 8.59
CHEMBL2386627 1 8.57
CHEMBL2386653 1 8.55
CHEMBL2386647 1 8.47
CHEMBL2386638 1 8.46
CHEMBL2386628 1 8.31
CHEMBL2386649 1 8.28
CHEMBL2386625 1 8.27
CHEMBL2386644 1 8.14
CHEMBL2159141 1 8.00
CHEMBL2386639 1 8.00
CHEMBL2386626 1 7.92
CHEMBL2386641 1 7.89
CHEMBL2386642 1 7.80
CHEMBL2386651 1 7.51

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2386635 Ki = 0.1 nM 10.00
CHEMBL2386636 Ki = 0.3 nM 9.52
CHEMBL221959 TOFACITINIB Ki = 0.7 nM 9.15
CHEMBL2386640 Ki = 0.8 nM 9.10
CHEMBL2386629 Ki = 0.8 nM 9.10
CHEMBL2386634 Ki = 0.9 nM 9.05
CHEMBL2386637 Ki = 1.1 nM 8.96
CHEMBL2386630 Ki = 1.1 nM 8.96
CHEMBL2386632 Ki = 1.2 nM 8.92
CHEMBL2159198 Ki = 1.3 nM 8.89
CHEMBL2386645 Ki = 1.6 nM 8.80
CHEMBL2386643 Ki = 1.8 nM 8.74
CHEMBL2386633 Ki = 1.9 nM 8.72
CHEMBL2386648 Ki = 2.0 nM 8.70
CHEMBL2385096 Ki = 2.0 nM 8.70
CHEMBL2386646 Ki = 2.6 nM 8.59
CHEMBL2386627 Ki = 2.7 nM 8.57
CHEMBL2386653 Ki = 2.8 nM 8.55
CHEMBL2386647 Ki = 3.4 nM 8.47
CHEMBL2386638 Ki = 3.5 nM 8.46
CHEMBL2386628 Ki = 4.9 nM 8.31
CHEMBL2386649 Ki = 5.2 nM 8.28
CHEMBL2386625 Ki = 5.4 nM 8.27
CHEMBL2386644 Ki = 7.2 nM 8.14
CHEMBL2159141 Ki = 10.0 nM 8.00
CHEMBL2386639 Ki = 10.0 nM 8.00
CHEMBL2386626 Ki = 12.0 nM 7.92
CHEMBL2386641 Ki = 13.0 nM 7.89
CHEMBL2386642 Ki = 16.0 nM 7.80
CHEMBL2386651 Ki = 31.0 nM 7.51
CHEMBL2386650 Ki = 43.0 nM 7.37
CHEMBL2152306 Ki = 46.0 nM 7.34
CHEMBL2386631 Ki = 53.0 nM 7.28
CHEMBL2386652 Ki = 68.0 nM 7.17