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Assay Detail

CHEMBL1225716

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ADMET
Inhibition of human CYP1A2 by EROD assay
18
Total Activities
18
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cytochrome P450 1A2 (CHEMBL3356)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Selective inhibition of methoxyflavonoids on human CYP1B1 activity.
Takemura H, Itoh T, Yamamoto K, Sakakibara H, Shimoi K.
Bioorg Med Chem (2010) 18 : 6310 -6315
PubMed 20696580 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 18 5.72 7.40

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL309490 GALANGIN 1 7.40
CHEMBL117 CHRYSIN 1 7.08
CHEMBL243664 ACACETIN 1 6.60
CHEMBL40919 KAEMPFERIDE 1 6.29
CHEMBL150 KAEMPFEROL 1.0 1 6.14
CHEMBL28 APIGENIN 1 6.10
CHEMBL214321 CHRYSOERIOL 1 5.95
CHEMBL226034 TAMARIXETIN 1 5.92
CHEMBL379064 ISORHAMNETIN 1 5.90
CHEMBL399910 PINOCEMBRIN 2.0 1 5.83
CHEMBL90568 DIOSMETIN 1 5.61
CHEMBL470266 ISOSAKUTANETIN 1 5.50
CHEMBL151 LUTEOLIN 2.0 1 5.47
CHEMBL50 QUERCETIN 3.0 1 5.39
CHEMBL9352 NARINGENIN 1 4.58
CHEMBL399121 HESPERETIN 0.5 1 4.46
CHEMBL490170 HOMOERIODICTYOL 1 4.42
CHEMBL8996 ERIODICTYOL 1 4.27

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL309490 GALANGIN IC50 = 40.0 nM 7.40
CHEMBL117 CHRYSIN IC50 = 84.0 nM 7.08
CHEMBL243664 ACACETIN IC50 = 251.0 nM 6.60
CHEMBL40919 KAEMPFERIDE IC50 = 509.0 nM 6.29
CHEMBL150 KAEMPFEROL IC50 = 716.0 nM 6.14
CHEMBL28 APIGENIN IC50 = 795.0 nM 6.10
CHEMBL214321 CHRYSOERIOL IC50 = 1118.0 nM 5.95
CHEMBL226034 TAMARIXETIN IC50 = 1215.0 nM 5.92
CHEMBL379064 ISORHAMNETIN IC50 = 1261.0 nM 5.90
CHEMBL399910 PINOCEMBRIN IC50 = 1491.0 nM 5.83
CHEMBL90568 DIOSMETIN IC50 = 2437.0 nM 5.61
CHEMBL470266 ISOSAKUTANETIN IC50 = 3147.0 nM 5.50
CHEMBL151 LUTEOLIN IC50 = 3370.0 nM 5.47
CHEMBL50 QUERCETIN IC50 = 4097.0 nM 5.39
CHEMBL9352 NARINGENIN IC50 = 26339.0 nM 4.58
CHEMBL399121 HESPERETIN IC50 = 34647.0 nM 4.46
CHEMBL490170 HOMOERIODICTYOL IC50 = 37768.0 nM 4.42
CHEMBL8996 ERIODICTYOL IC50 = 53214.0 nM 4.27