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Assay Detail

CHEMBL5166382

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

Binding
Inhibition of recombinant full length human DAO preincubated with compound for 20 mins measured after 4 hrs by Amplex red and horseradish peroxidase based fluorescence assay
ChEMBL ↗
52
Total Activities
52
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

D-amino-acid oxidase (CHEMBL5485) ↗
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of a Novel Class of d-Amino Acid Oxidase Inhibitors Using the Schrödinger Computational Platform.
Tang H, Jensen K, Houang E, McRobb FM, Bhat S, Svensson M, Bochevarov A, Day T, Dahlgren MK, Bell JA, Frye L, Skene RJ, Lewis JH, Osborne JD, Tierney JP, Gordon JA, Palomero MA, Gallati C, Chapman RSL, Jones DR, Hirst KL, Sephton M, Chauhan A, Sharpe A, Tardia P, Dechaux EA, Taylor A, Waddell RD, Valentine A, Janssens HB, Aziz O, Bloomfield DE, Ladha S, Fraser IJ, Ellard JM.
J Med Chem (2022) 65 : 6775 -6802
PubMed 35482677 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 52 6.89 8.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5184138 — — 1 8.10
CHEMBL5188193 — — 1 8.05
CHEMBL5204161 — — 1 8.05
CHEMBL5173250 — — 1 7.96
CHEMBL5179642 — — 1 7.89
CHEMBL3937708 — — 1 7.77
CHEMBL5178413 — — 1 7.70
CHEMBL5186374 — — 1 7.70
CHEMBL5179643 — — 1 7.68
CHEMBL5174518 — — 1 7.60
CHEMBL5196542 — — 1 7.60
CHEMBL5204839 — — 1 7.55
CHEMBL5180296 — — 1 7.37
CHEMBL5184060 — — 1 7.34
CHEMBL5179598 — — 1 7.29
CHEMBL5208196 — — 1 7.27
CHEMBL5188286 — — 1 7.16
CHEMBL5191702 — — 1 7.14
CHEMBL5183719 — — 1 7.10
CHEMBL5179752 — — 1 7.09
CHEMBL5201918 — — 1 7.06
CHEMBL5192292 — — 1 7.05
CHEMBL5178658 — — 1 7.04
CHEMBL5173262 — — 1 7.04
CHEMBL5189921 — — 1 7.03
CHEMBL5202977 — — 1 7.03
CHEMBL5190430 — — 1 7.01
CHEMBL5176574 — — 1 7.01
CHEMBL5194500 — — 1 6.92
CHEMBL5176256 — — 1 6.89

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5184138 — IC50 = 8.0 nM 8.10
CHEMBL5188193 — IC50 = 9.0 nM 8.05
CHEMBL5204161 — IC50 = 9.0 nM 8.05
CHEMBL5173250 — IC50 = 11.0 nM 7.96
CHEMBL5179642 — IC50 = 13.0 nM 7.89
CHEMBL3937708 — IC50 = 17.0 nM 7.77
CHEMBL5178413 — IC50 = 20.0 nM 7.70
CHEMBL5186374 — IC50 = 20.0 nM 7.70
CHEMBL5179643 — IC50 = 21.0 nM 7.68
CHEMBL5174518 — IC50 = 25.0 nM 7.60
CHEMBL5196542 — IC50 = 25.0 nM 7.60
CHEMBL5204839 — IC50 = 28.0 nM 7.55
CHEMBL5180296 — IC50 = 43.0 nM 7.37
CHEMBL5184060 — IC50 = 46.0 nM 7.34
CHEMBL5179598 — IC50 = 51.0 nM 7.29
CHEMBL5208196 — IC50 = 54.0 nM 7.27
CHEMBL5188286 — IC50 = 70.0 nM 7.16
CHEMBL5191702 — IC50 = 72.0 nM 7.14
CHEMBL5183719 — IC50 = 80.0 nM 7.10
CHEMBL5179752 — IC50 = 82.0 nM 7.09
CHEMBL5201918 — IC50 = 87.0 nM 7.06
CHEMBL5192292 — IC50 = 90.0 nM 7.05
CHEMBL5178658 — IC50 = 92.0 nM 7.04
CHEMBL5173262 — IC50 = 91.0 nM 7.04
CHEMBL5202977 — IC50 = 94.0 nM 7.03
CHEMBL5189921 — IC50 = 93.0 nM 7.03
CHEMBL5190430 — IC50 = 98.0 nM 7.01
CHEMBL5176574 — IC50 = 97.0 nM 7.01
CHEMBL5194500 — IC50 = 120.0 nM 6.92
CHEMBL5176256 — IC50 = 130.0 nM 6.89
CHEMBL5185870 — IC50 = 150.0 nM 6.82
CHEMBL5174605 — IC50 = 180.0 nM 6.75
CHEMBL5176152 — IC50 = 190.0 nM 6.72
CHEMBL5181983 — IC50 = 250.0 nM 6.60
CHEMBL5176414 — IC50 = 250.0 nM 6.60
CHEMBL5200372 — IC50 = 300.0 nM 6.52
CHEMBL5202673 — IC50 = 320.0 nM 6.50
CHEMBL5178020 — IC50 = 320.0 nM 6.50
CHEMBL5186984 — IC50 = 320.0 nM 6.50
CHEMBL5202169 — IC50 = 340.0 nM 6.47
CHEMBL5194769 — IC50 = 340.0 nM 6.47
CHEMBL5178002 — IC50 = 406.0 nM 6.39
CHEMBL5205206 — IC50 = 440.0 nM 6.36
CHEMBL5179137 — IC50 = 580.0 nM 6.24
CHEMBL5186364 — IC50 = 640.0 nM 6.19
CHEMBL5203007 — IC50 = 670.0 nM 6.17
CHEMBL5184409 — IC50 = 1500.0 nM 5.82
CHEMBL5186214 — IC50 = 2500.0 nM 5.60
CHEMBL5191030 — IC50 = 3300.0 nM 5.48
CHEMBL5204414 — IC50 = 3900.0 nM 5.41