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Assay Detail

CHEMBL4477153

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Binding
Inhibition of N-terminal HIS-tagged and TEV cleavage site containing full length PHGDH (unknown origin) expressed in Escherichia coli assessed as reduction in conversion of 3-Phosphoglycerate and NAD to 3-Phosphohydroxypyruvate and NADH using 250 uM NAD and 500 uM 3-PG incubated for 240 mins by fluorescence based assay
192
Total Activities
192
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-3-phosphoglycerate dehydrogenase (CHEMBL2311243)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Tosylacetate based compounds and derivatives thereof as phgdh inhibitors
(2018)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 192 6.37 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4527607 1 8.52
CHEMBL4520837 1 8.52
CHEMBL4515492 1 8.52
CHEMBL4542437 1 8.40
CHEMBL4436264 1 8.40
CHEMBL4548014 1 8.30
CHEMBL4483622 1 8.30
CHEMBL4587306 1 8.30
CHEMBL4547034 1 8.22
CHEMBL4533417 1 8.22
CHEMBL4483483 1 8.22
CHEMBL4560976 1 8.15
CHEMBL4548203 1 8.15
CHEMBL4580665 1 8.10
CHEMBL4467246 1 8.10
CHEMBL4517873 1 8.10
CHEMBL4585012 1 8.10
CHEMBL4518612 1 8.05
CHEMBL4513843 1 8.00
CHEMBL4592933 1 8.00
CHEMBL4547905 1 7.96
CHEMBL4517506 1 7.96
CHEMBL4572814 1 7.92
CHEMBL4572184 1 7.89
CHEMBL4587964 1 7.77
CHEMBL4551822 1 7.70
CHEMBL4524231 1 7.68
CHEMBL4556963 1 7.62
CHEMBL4541970 1 7.57
CHEMBL4576106 1 7.54

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4515492 IC50 = 3.0 nM 8.52
CHEMBL4527607 IC50 = 3.0 nM 8.52
CHEMBL4520837 IC50 = 3.0 nM 8.52
CHEMBL4542437 IC50 = 4.0 nM 8.40
CHEMBL4436264 IC50 = 4.0 nM 8.40
CHEMBL4587306 IC50 = 5.0 nM 8.30
CHEMBL4483622 IC50 = 5.0 nM 8.30
CHEMBL4548014 IC50 = 5.0 nM 8.30
CHEMBL4547034 IC50 = 6.0 nM 8.22
CHEMBL4533417 IC50 = 6.0 nM 8.22
CHEMBL4483483 IC50 = 6.0 nM 8.22
CHEMBL4560976 IC50 = 7.0 nM 8.15
CHEMBL4548203 IC50 = 7.0 nM 8.15
CHEMBL4467246 IC50 = 8.0 nM 8.10
CHEMBL4580665 IC50 = 8.0 nM 8.10
CHEMBL4585012 IC50 = 8.0 nM 8.10
CHEMBL4517873 IC50 = 8.0 nM 8.10
CHEMBL4518612 IC50 = 9.0 nM 8.05
CHEMBL4513843 IC50 = 10.0 nM 8.00
CHEMBL4592933 IC50 = 10.0 nM 8.00
CHEMBL4547905 IC50 = 11.0 nM 7.96
CHEMBL4517506 IC50 = 11.0 nM 7.96
CHEMBL4572814 IC50 = 12.0 nM 7.92
CHEMBL4572184 IC50 = 13.0 nM 7.89
CHEMBL4587964 IC50 = 17.0 nM 7.77
CHEMBL4551822 IC50 = 20.0 nM 7.70
CHEMBL4524231 IC50 = 21.0 nM 7.68
CHEMBL4556963 IC50 = 24.0 nM 7.62
CHEMBL4541970 IC50 = 27.0 nM 7.57
CHEMBL4576106 IC50 = 29.0 nM 7.54
CHEMBL4580853 IC50 = 35.0 nM 7.46
CHEMBL4549808 IC50 = 40.0 nM 7.40
CHEMBL4557402 IC50 = 41.0 nM 7.39
CHEMBL4552712 IC50 = 52.0 nM 7.28
CHEMBL4521930 IC50 = 53.0 nM 7.28
CHEMBL4513944 IC50 = 54.0 nM 7.27
CHEMBL4574871 IC50 = 54.0 nM 7.27
CHEMBL4516261 IC50 = 61.0 nM 7.21
CHEMBL4578446 IC50 = 61.0 nM 7.21
CHEMBL4569609 IC50 = 62.0 nM 7.21
CHEMBL4550369 IC50 = 72.0 nM 7.14
CHEMBL4568292 IC50 = 74.0 nM 7.13
CHEMBL4530767 IC50 = 76.0 nM 7.12
CHEMBL4521064 IC50 = 84.0 nM 7.08
CHEMBL4572318 IC50 = 85.0 nM 7.07
CHEMBL4545772 IC50 = 87.0 nM 7.06
CHEMBL4483039 IC50 = 89.0 nM 7.05
CHEMBL4536159 IC50 = 98.0 nM 7.01
CHEMBL4578573 IC50 = 98.0 nM 7.01
CHEMBL4514983 IC50 = 120.0 nM 6.92