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Assay Detail

CHEMBL4730499

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

Binding
Displacement of [3H]-SB67404 from human orexin 1 receptor expressed in CHO cells incubated for 2 hrs by whole cell radioligand binding assay
124
Total Activities
124
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type CHO
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Orexin/Hypocretin receptor type 1 (CHEMBL5113)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Based Discovery of Novel Ligands for the Orexin 2 Receptor.
Gunera J,Baker JG,van Hilten N,Rosenbaum DM,Kolb P
J Med Chem (2020) 63 : 11045 -11053
PubMed 32977721 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
pKi 60 - -
IC50 34 - -
Ki 30 5.28 8.51

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1083659 SUVOREXANT 4.0 1 8.51
CHEMBL2110363 1 8.41
CHEMBL4776564 1 7.38
CHEMBL4759509 1 5.90
CHEMBL359632 1 5.87
CHEMBL4795679 1 5.49
CHEMBL4756004 1 5.45
CHEMBL2385132 1 5.35
CHEMBL4076997 1 5.29
CHEMBL4788760 1 5.27
CHEMBL4763441 1 5.11
CHEMBL4799630 1 5.10
CHEMBL4759413 1 5.05
CHEMBL4752300 1 4.93
CHEMBL4787509 1 4.83
CHEMBL4756045 1 4.83
CHEMBL4761896 1 4.83
CHEMBL4790273 1 4.82
CHEMBL4799045 1 4.81
CHEMBL4758573 1 4.77
CHEMBL4761684 1 4.75
CHEMBL4741048 1 4.68
CHEMBL4753295 1 4.67
CHEMBL4793440 1 4.61
CHEMBL4756829 1 4.61
CHEMBL4747508 1 4.49
CHEMBL4753288 1 4.48
CHEMBL4745747 1 4.47
CHEMBL4750883 1 4.36
CHEMBL4780476 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1083659 SUVOREXANT Ki = 3.09 nM 8.51
CHEMBL2110363 Ki = 3.89 nM 8.41
CHEMBL4776564 Ki = 41.69 nM 7.38
CHEMBL4759509 Ki = 1258.93 nM 5.90
CHEMBL359632 Ki = 1348.96 nM 5.87
CHEMBL4795679 Ki = 3235.94 nM 5.49
CHEMBL4756004 Ki = 3548.13 nM 5.45
CHEMBL2385132 Ki = 4466.84 nM 5.35
CHEMBL4076997 Ki = 5128.61 nM 5.29
CHEMBL4788760 Ki = 5370.32 nM 5.27
CHEMBL4763441 Ki = 7762.47 nM 5.11
CHEMBL4799630 Ki = 7943.28 nM 5.10
CHEMBL4759413 Ki = 8912.51 nM 5.05
CHEMBL4752300 Ki = 11748.98 nM 4.93
CHEMBL4787509 Ki = 14791.08 nM 4.83
CHEMBL4761896 Ki = 14791.08 nM 4.83
CHEMBL4756045 Ki = 14791.08 nM 4.83
CHEMBL4790273 Ki = 15135.61 nM 4.82
CHEMBL4799045 Ki = 15488.17 nM 4.81
CHEMBL4758573 Ki = 16982.44 nM 4.77
CHEMBL4761684 Ki = 17782.79 nM 4.75
CHEMBL4741048 Ki = 20892.96 nM 4.68
CHEMBL4753295 Ki = 21379.62 nM 4.67
CHEMBL4756829 Ki = 24547.09 nM 4.61
CHEMBL4793440 Ki = 24547.09 nM 4.61
CHEMBL4747508 Ki = 32359.37 nM 4.49
CHEMBL4753288 Ki = 33113.11 nM 4.48
CHEMBL4745747 Ki = 33884.42 nM 4.47
CHEMBL4750883 Ki = 43651.58 nM 4.36
CHEMBL4741042 pKi - -
CHEMBL4788750 IC50 > 100000.0 nM -
CHEMBL4778501 Ki = 1000000000.0 nM -
CHEMBL4749594 pKi - -
CHEMBL4799524 pKi - -
CHEMBL4756190 pKi - -
CHEMBL4748304 IC50 > 100000.0 nM -
CHEMBL4760031 pKi - -
CHEMBL4755753 pKi - -
CHEMBL4753145 pKi - -
CHEMBL4754646 IC50 > 100000.0 nM -
CHEMBL4780171 IC50 > 100000.0 nM -
CHEMBL4749246 pKi - -
CHEMBL4778037 pKi - -
CHEMBL4790207 pKi - -
CHEMBL4750232 pKi - -
CHEMBL4749292 IC50 > 100000.0 nM -
CHEMBL4798150 pKi - -
CHEMBL4745417 pKi - -
CHEMBL4788931 pKi - -
CHEMBL4755236 IC50 > 100000.0 nM -