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TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50351401(CHEMBL1819091)
Affinity DataKi:  0.0220nMAssay Description:Inhibition of CYP3A4 in human liver microsomes pre-incubated for 15 mins by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50351399(CHEMBL1819089)
Affinity DataKi:  0.0260nMAssay Description:Inhibition of CYP3A4 in human liver microsomes pre-incubated for 15 mins by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM144637(US8952036, Ex. 5)
Affinity DataIC50: 0.0503nMpH: 7.4 T: 2°CAssay Description:The standard assay conditions for the in vitro HTRF assay consisted of a 50 ul total reaction volume in black 384-well Costar polypropylene plates in...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2015
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50448963(CHEMBL3125537 | US9296736, 351 | US9593129, Exampl...)
Affinity DataIC50: 0.0962nMpH: 7.4 T: 2°CAssay Description:The standard assay conditions for the in vitro HTRF assay consisted of a 50 ul total reaction volume in black 384-well Costar polypropylene plates in...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2015
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50337733(N-((2S,4S)-1-(4-(2,4-dichlorobenzyloxy)piperidin-1...)
Affinity DataIC50: 0.100nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM144636(US8952036, Ex. 4)
Affinity DataIC50: 0.102nMpH: 7.4 T: 2°CAssay Description:The standard assay conditions for the in vitro HTRF assay consisted of a 50 ul total reaction volume in black 384-well Costar polypropylene plates in...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2015
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM8610(24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...)
Affinity DataIC50: 0.180nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330011(1-((3R,5R)-4-(4-chlorophenylsulfonyl)-5-isopropylm...)
Affinity DataIC50: 0.300nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM144638(US8952036, Ex. 3)
Affinity DataIC50: 0.330nMpH: 7.4 T: 2°CAssay Description:The standard assay conditions for the in vitro HTRF assay consisted of a 50 ul total reaction volume in black 384-well Costar polypropylene plates in...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2015
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252094((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 0.400nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM143355(US9682953, 20.A-1)
Affinity DataIC50: 0.400nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using testosterone as substrate preincubated for 5 mins followed by NADPH cofactor addition and measur...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/22/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330016(((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(1-methylcyc...)
Affinity DataIC50: 0.5nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252295(3-(6-(4-((1R,4S)-5-oxa-2-aza-bicyclo[2.2.1]heptan-...)
Affinity DataIC50: 0.5nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330006(1-((3R,5R)-4-(4-chlorophenylsulfonyl)-5-isopropylm...)
Affinity DataIC50: 0.5nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252237((S)-methyl 1-(2-(4-(2-(3-chlorophenyl)-2-hydroxyet...)
Affinity DataIC50: 0.5nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM27879(CHEMBL401930 | 4-{[(2S)-2-(3-chlorophenyl)-2-hydro...)
Affinity DataIC50: 0.5nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252193(4-((S)-2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 0.700nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252236((S)-N-(1-(2-(4-(2-(3-chlorophenyl)-2-hydroxyethyla...)
Affinity DataIC50: 0.700nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330017(1-((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(cycloprop...)
Affinity DataIC50: 0.800nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252297((S)-3-(6-(4-(4-acetylpiperazin-1-yl)piperidin-1-yl...)
Affinity DataIC50: 0.800nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252143((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 0.900nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50544198(CHEMBL4636136)
Affinity DataIC50: 0.900nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50376467(CHEMBL260636)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM8610(24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4 (unknown origin) using DBF as substrate preincubated for 5 mins followed by substrate addition by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/14/2024
Entry Details
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM8610(24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using testosterone as substrate after 5 mins by LC-MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2017
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252142((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50586268(CHEMBL5079148)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50376470(CHEMBL405895)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252238((S)-methyl 1-(2-(4-(2-(3-chlorophenyl)-2-hydroxyet...)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM31772(Brentan | 1-[2-(2,4-dichlorobenzyl)oxy-2-(2,4-dich...)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4 in human liver Microsome using midazolam as substrate in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50428877(CHEMBL2338480)
Affinity DataIC50: 1nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252144((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 1.30nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50337730(N-((2S,4S)-1-(4-(4-fluorophenyl)piperazin-1-ylsulf...)
Affinity DataIC50: 1.40nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330023(1-((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(cycloprop...)
Affinity DataIC50: 1.40nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50297370(3-(3-(tert-butylthio)-5-(pyridin-2-ylmethoxy)-1-(4...)
Affinity DataIC50: 1.40nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330015(((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(1-methylcyc...)
Affinity DataIC50: 1.5nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252300((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 1.70nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252303((S)-2-hydroxyethyl 4-(1-(2-(4-(2-(3-chlorophenyl)-...)
Affinity DataIC50: 1.80nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50008760(CHEMBL3236364)
Affinity DataIC50: 1.83nMpH: 7.4 T: 2°CAssay Description:The standard assay conditions for the in vitro HTRF assay consisted of a 50 ul total reaction volume in black 384-well Costar polypropylene plates in...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2015
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330022((3S,5R)-1-((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(c...)
Affinity DataIC50: 2nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 2nMAssay Description:Inhibition of human CYP3A4 by time-dependent inhibition assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50330018(1-((3R,5R)-4-(4-chlorophenylsulfonyl)-5-(cycloprop...)
Affinity DataIC50: 2.30nMAssay Description:Inhibition of CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/13/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252302((S)-2-methoxyethyl 4-(1-(2-(4-(2-(3-chlorophenyl)-...)
Affinity DataIC50: 2.40nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252296((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 2.40nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM8610(24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...)
Affinity DataIC50: 2.40nMAssay Description:Inhibition of CYP3A4 (unknown origin) using BOMCC as a substrate incubated for 20 mins by fluorescence based analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM143355(US9682953, 20.A-1)
Affinity DataIC50: 2.40nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate preincubated for 5 mins followed by NADPH cofactor addition and measured ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/22/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252194((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 2.60nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252299((S)-4-(2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 3nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50234534(CHEMBL4088945)
Affinity DataIC50: 3nMAssay Description:Inhibition of human CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/15/2019
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Dainippon Sumitomo Pharma

Curated by ChEMBL
LigandPNGBDBM50252294(4-((S)-2-(3-chlorophenyl)-2-hydroxyethylamino)-3-(...)
Affinity DataIC50: 3.10nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
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