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Assay Detail

CHEMBL2444440

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

Binding
Inhibition of DPP8 (unknown origin)
34
Total Activities
27
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

Dipeptidyl peptidase 8 (CHEMBL4657)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Optimization of activity, selectivity, and liability profiles in 5-oxopyrrolopyridine DPP4 inhibitors leading to clinical candidate (Sa)-2-(3-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl-5-oxo-5H-pyrrolo[3,4-b]pyridin-6(7H)-yl)-N,N-dimethylacetamide (BMS-767778).
Devasthale P, Wang Y, Wang W, Fevig J, Feng J, Wang A, Harrity T, Egan D, Morgan N, Cap M, Fura A, Klei HE, Kish K, Weigelt C, Sun L, Levesque P, Moulin F, Li YX, Zahler R, Kirby MS, Hamann LG.
J Med Chem (2013) 56 : 7343 -7357
PubMed 23964740 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 34 8.48 9.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2441846 1 9.10
CHEMBL2441955 1 9.00
CHEMBL2441844 2 9.00
CHEMBL2441954 1 8.85
CHEMBL2441839 1 8.85
CHEMBL2441837 2 8.77
CHEMBL2441845 1 8.74
CHEMBL2441953 1 8.70
CHEMBL2441829 1 8.55
CHEMBL2441841 1 8.42
CHEMBL2441830 3 8.42
CHEMBL2441848 1 8.42
CHEMBL2441838 1 8.41
CHEMBL2441847 1 8.41
CHEMBL2441951 1 8.37
CHEMBL2441952 2 8.31
CHEMBL2441833 1 8.28
CHEMBL2441828 1 8.28
CHEMBL2441836 3 8.27
CHEMBL2441831 1 8.26
CHEMBL2441835 1 8.22
CHEMBL2441832 1 8.19
CHEMBL2441834 1 8.05
CHEMBL2441950 1 7.89
CHEMBL2441843 1 -
CHEMBL2441842 1 -
CHEMBL2441840 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2441846 Ki = 0.8 nM 9.10
CHEMBL2441955 Ki = 1.0 nM 9.00
CHEMBL2441844 Ki = 1.0 nM 9.00
CHEMBL2441954 Ki = 1.4 nM 8.85
CHEMBL2441839 Ki = 1.4 nM 8.85
CHEMBL2441837 Ki = 1.7 nM 8.77
CHEMBL2441845 Ki = 1.8 nM 8.74
CHEMBL2441953 Ki = 2.0 nM 8.70
CHEMBL2441844 Ki = 2.5 nM 8.60
CHEMBL2441829 Ki = 2.8 nM 8.55
CHEMBL2441848 Ki = 3.8 nM 8.42
CHEMBL2441841 Ki = 3.8 nM 8.42
CHEMBL2441830 Ki = 3.8 nM 8.42
CHEMBL2441847 Ki = 3.9 nM 8.41
CHEMBL2441838 Ki = 3.9 nM 8.41
CHEMBL2441830 Ki = 3.9 nM 8.41
CHEMBL2441951 Ki = 4.3 nM 8.37
CHEMBL2441952 Ki = 4.9 nM 8.31
CHEMBL2441828 Ki = 5.2 nM 8.28
CHEMBL2441833 Ki = 5.2 nM 8.28
CHEMBL2441836 Ki = 5.4 nM 8.27
CHEMBL2441831 Ki = 5.5 nM 8.26
CHEMBL2441835 Ki = 6.0 nM 8.22
CHEMBL2441832 Ki = 6.4 nM 8.19
CHEMBL2441836 Ki = 7.1 nM 8.15
CHEMBL2441834 Ki = 8.9 nM 8.05
CHEMBL2441950 Ki = 13.0 nM 7.89
CHEMBL2441836 Ki > 30.0 nM -
CHEMBL2441837 Ki > 30.0 nM -
CHEMBL2441830 Ki > 30.0 nM -
CHEMBL2441840 Ki > 30.0 nM -
CHEMBL2441842 Ki > 30.0 nM -
CHEMBL2441843 Ki > 30.0 nM -
CHEMBL2441952 Ki > 30.0 nM -