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Compile Data Set for Download or QSAR

Found 32 hits from AbbVie, Inc.   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286461
PNG
(CHEMBL4166626)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H30N4O5/c1-17(19-8-9-19)30(15-18-6-4-3-5-7-18)23(32)16-31-24(33)27(36-26(31)35)13-12-20-14-21(10-11-22(20)27)29-25(34)28-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H2,28,29,34)/t17-,27+/m0/s1
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n/an/a 25n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286424
PNG
(CHEMBL4170186)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@H](C3CC3)C(F)(F)F)C2=O)c1
Show InChI InChI=1S/C27H27F3N4O5/c1-31-24(37)32-19-9-10-20-18(13-19)11-12-26(20)23(36)34(25(38)39-26)15-21(35)33(14-16-5-3-2-4-6-16)22(17-7-8-17)27(28,29)30/h2-6,9-10,13,17,22H,7-8,11-12,14-15H2,1H3,(H2,31,32,37)/t22-,26-/m1/s1
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n/an/a 32n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286424
PNG
(CHEMBL4170186)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@H](C3CC3)C(F)(F)F)C2=O)c1
Show InChI InChI=1S/C27H27F3N4O5/c1-31-24(37)32-19-9-10-20-18(13-19)11-12-26(20)23(36)34(25(38)39-26)15-21(35)33(14-16-5-3-2-4-6-16)22(17-7-8-17)27(28,29)30/h2-6,9-10,13,17,22H,7-8,11-12,14-15H2,1H3,(H2,31,32,37)/t22-,26-/m1/s1
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n/an/a 45n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP in human PC3 cells assessed as reduction in acetylated H3K27 levels after 3 hrs by fluorescence assay


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286461
PNG
(CHEMBL4166626)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H30N4O5/c1-17(19-8-9-19)30(15-18-6-4-3-5-7-18)23(32)16-31-24(33)27(36-26(31)35)13-12-20-14-21(10-11-22(20)27)29-25(34)28-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H2,28,29,34)/t17-,27+/m0/s1
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n/an/a 47n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP in human PC3 cells assessed as reduction in acetylated H3K27 levels after 3 hrs by fluorescence assay


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286423
PNG
(CHEMBL4174931)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C(F)(F)F)C2=O)c1
Show InChI InChI=1S/C25H25F3N4O5/c1-15(25(26,27)28)31(13-16-6-4-3-5-7-16)20(33)14-32-21(34)24(37-23(32)36)11-10-17-12-18(8-9-19(17)24)30-22(35)29-2/h3-9,12,15H,10-11,13-14H2,1-2H3,(H2,29,30,35)/t15-,24+/m0/s1
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n/an/a 60n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286423
PNG
(CHEMBL4174931)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C(F)(F)F)C2=O)c1
Show InChI InChI=1S/C25H25F3N4O5/c1-15(25(26,27)28)31(13-16-6-4-3-5-7-16)20(33)14-32-21(34)24(37-23(32)36)11-10-17-12-18(8-9-19(17)24)30-22(35)29-2/h3-9,12,15H,10-11,13-14H2,1-2H3,(H2,29,30,35)/t15-,24+/m0/s1
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n/an/a 101n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP in human PC3 cells assessed as reduction in acetylated H3K27 levels after 3 hrs by fluorescence assay


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286465
PNG
(CHEMBL4177251)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H30N4O5/c1-17(19-8-9-19)30(15-18-6-4-3-5-7-18)23(32)16-31-24(33)27(36-26(31)35)13-12-20-14-21(10-11-22(20)27)29-25(34)28-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H2,28,29,34)/t17-,27-/m0/s1
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n/an/a 121n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286459
PNG
(CHEMBL4163183)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@]22NC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H31N5O4/c1-17(19-8-9-19)31(15-18-6-4-3-5-7-18)23(33)16-32-24(34)27(30-26(32)36)13-12-20-14-21(10-11-22(20)27)29-25(35)28-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H,30,36)(H2,28,29,35)/t17-,27-/m0/s1
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AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286469
PNG
(CHEMBL4173894)
Show SMILES CNC(=O)Nc1ccc2c(CCC22NC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H31N5O4/c1-17(19-8-9-19)31(15-18-6-4-3-5-7-18)23(33)16-32-24(34)27(30-26(32)36)13-12-20-14-21(10-11-22(20)27)29-25(35)28-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H,30,36)(H2,28,29,35)/t17-,27?/m0/s1
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n/an/a 240n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286459
PNG
(CHEMBL4163183)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@]22NC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H31N5O4/c1-17(19-8-9-19)31(15-18-6-4-3-5-7-18)23(33)16-32-24(34)27(30-26(32)36)13-12-20-14-21(10-11-22(20)27)29-25(35)28-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H,30,36)(H2,28,29,35)/t17-,27-/m0/s1
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AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP in human PC3 cells assessed as reduction in acetylated H3K27 levels after 3 hrs by fluorescence assay


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286476
PNG
(CHEMBL4168543)
Show SMILES C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)N[C@]2(CCc3ccccc23)C1=O
Show InChI InChI=1S/C25H27N3O3/c1-17(19-11-12-19)27(15-18-7-3-2-4-8-18)22(29)16-28-23(30)25(26-24(28)31)14-13-20-9-5-6-10-21(20)25/h2-10,17,19H,11-16H2,1H3,(H,26,31)/t17-,25-/m0/s1
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AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286465
PNG
(CHEMBL4177251)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H30N4O5/c1-17(19-8-9-19)30(15-18-6-4-3-5-7-18)23(32)16-31-24(33)27(36-26(31)35)13-12-20-14-21(10-11-22(20)27)29-25(34)28-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H2,28,29,34)/t17-,27-/m0/s1
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n/an/a 760n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP in human PC3 cells assessed as reduction in acetylated H3K27 levels after 3 hrs by fluorescence assay


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286477
PNG
(CHEMBL4167383)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3cc(NC(C)=O)ccc23)C1=O
Show InChI InChI=1S/C27H30N4O4/c1-17(20-8-9-20)30(15-19-6-4-3-5-7-19)24(33)16-31-25(34)27(29-26(31)35)13-12-21-14-22(28-18(2)32)10-11-23(21)27/h3-7,10-11,14,17,20H,8-9,12-13,15-16H2,1-2H3,(H,28,32)(H,29,35)
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AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
Cytochrome P450 2C8


(Homo sapiens (Human))
BDBM50286423
PNG
(CHEMBL4174931)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C(F)(F)F)C2=O)c1
Show InChI InChI=1S/C25H25F3N4O5/c1-15(25(26,27)28)31(13-16-6-4-3-5-7-16)20(33)14-32-21(34)24(37-23(32)36)11-10-17-12-18(8-9-19(17)24)30-22(35)29-2/h3-9,12,15H,10-11,13-14H2,1-2H3,(H2,29,30,35)/t15-,24+/m0/s1
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n/an/a 990n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of CYP2C8 (unknown origin)


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286466
PNG
(CHEMBL4171897)
Show SMILES C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)N[C@]2(CCc3ccccc23)C1=O
Show InChI InChI=1S/C25H27N3O3/c1-17(19-11-12-19)27(15-18-7-3-2-4-8-18)22(29)16-28-23(30)25(26-24(28)31)14-13-20-9-5-6-10-21(20)25/h2-10,17,19H,11-16H2,1H3,(H,26,31)/t17-,25+/m1/s1
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n/an/a 990n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286464
PNG
(CHEMBL4176737)
Show SMILES COC(=O)Nc1ccc2c(CCC22NC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C3CC3)C2=O)c1
Show InChI InChI=1S/C27H30N4O5/c1-17(19-8-9-19)30(15-18-6-4-3-5-7-18)23(32)16-31-24(33)27(29-25(31)34)13-12-20-14-21(10-11-22(20)27)28-26(35)36-2/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H,28,35)(H,29,34)/t17-,27?/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286478
PNG
(CHEMBL4160129)
Show SMILES COc1ccc2c(CCC22NC(=O)N(CC(=O)N(Cc3ccccc3)C(C)C3CC3)C2=O)c1
Show InChI InChI=1S/C26H29N3O4/c1-17(19-8-9-19)28(15-18-6-4-3-5-7-18)23(30)16-29-24(31)26(27-25(29)32)13-12-20-14-21(33-2)10-11-22(20)26/h3-7,10-11,14,17,19H,8-9,12-13,15-16H2,1-2H3,(H,27,32)
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n/an/a 1.60E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
Cytochrome P450 2C9


(Homo sapiens (Human))
BDBM50286423
PNG
(CHEMBL4174931)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C(F)(F)F)C2=O)c1
Show InChI InChI=1S/C25H25F3N4O5/c1-15(25(26,27)28)31(13-16-6-4-3-5-7-16)20(33)14-32-21(34)24(37-23(32)36)11-10-17-12-18(8-9-19(17)24)30-22(35)29-2/h3-9,12,15H,10-11,13-14H2,1-2H3,(H2,29,30,35)/t15-,24+/m0/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of CYP2C9 (unknown origin)


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286475
PNG
(CHEMBL4167931)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3ccccc23)C1=O
Show InChI InChI=1S/C25H27N3O3/c1-17(19-11-12-19)27(15-18-7-3-2-4-8-18)22(29)16-28-23(30)25(26-24(28)31)14-13-20-9-5-6-10-21(20)25/h2-10,17,19H,11-16H2,1H3,(H,26,31)
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n/an/a 1.60E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286462
PNG
(CHEMBL4175251)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3cc(ccc23)C2CC2)C1=O
Show InChI InChI=1S/C28H31N3O3/c1-18(20-7-8-20)30(16-19-5-3-2-4-6-19)25(32)17-31-26(33)28(29-27(31)34)14-13-23-15-22(21-9-10-21)11-12-24(23)28/h2-6,11-12,15,18,20-21H,7-10,13-14,16-17H2,1H3,(H,29,34)
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n/an/a 1.71E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286473
PNG
(CHEMBL4171809)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3cc(ccc23)C#N)C1=O
Show InChI InChI=1S/C26H26N4O3/c1-17(20-8-9-20)29(15-18-5-3-2-4-6-18)23(31)16-30-24(32)26(28-25(30)33)12-11-21-13-19(14-27)7-10-22(21)26/h2-7,10,13,17,20H,8-9,11-12,15-16H2,1H3,(H,28,33)
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n/an/a 2.50E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286460
PNG
(CHEMBL4176407)
Show SMILES C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC(C1=O)c1ccccc1C
Show InChI InChI=1S/C24H27N3O3/c1-16-8-6-7-11-20(16)22-23(29)27(24(30)25-22)15-21(28)26(17(2)19-12-13-19)14-18-9-4-3-5-10-18/h3-11,17,19,22H,12-15H2,1-2H3,(H,25,30)/t17-,22?/m0/s1
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n/an/a 2.70E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286472
PNG
(CHEMBL4168449)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3cc(ccc23)C(N)=O)C1=O
Show InChI InChI=1S/C26H28N4O4/c1-16(18-7-8-18)29(14-17-5-3-2-4-6-17)22(31)15-30-24(33)26(28-25(30)34)12-11-19-13-20(23(27)32)9-10-21(19)26/h2-6,9-10,13,16,18H,7-8,11-12,14-15H2,1H3,(H2,27,32)(H,28,34)
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n/an/a 4.86E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286467
PNG
(CHEMBL4161300)
Show SMILES C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)N[C@@]2(CCc3ccccc23)C1=O
Show InChI InChI=1S/C25H27N3O3/c1-17(19-11-12-19)27(15-18-7-3-2-4-8-18)22(29)16-28-23(30)25(26-24(28)31)14-13-20-9-5-6-10-21(20)25/h2-10,17,19H,11-16H2,1H3,(H,26,31)/t17-,25+/m0/s1
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n/an/a 5.06E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286457
PNG
(CHEMBL4159813)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC(Cc2c[nH]c3ccccc23)C1=O
Show InChI InChI=1S/C26H28N4O3/c1-17(19-11-12-19)29(15-18-7-3-2-4-8-18)24(31)16-30-25(32)23(28-26(30)33)13-20-14-27-22-10-6-5-9-21(20)22/h2-10,14,17,19,23,27H,11-13,15-16H2,1H3,(H,28,33)
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n/an/a 5.10E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286468
PNG
(CHEMBL4165120)
Show SMILES C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC(C1=O)c1ccccc1
Show InChI InChI=1S/C23H25N3O3/c1-16(18-12-13-18)25(14-17-8-4-2-5-9-17)20(27)15-26-22(28)21(24-23(26)29)19-10-6-3-7-11-19/h2-11,16,18,21H,12-15H2,1H3,(H,24,29)/t16-,21?/m0/s1
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n/an/a 7.60E+3n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286479
PNG
(CHEMBL4164715)
Show SMILES C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)N[C@@]2(CCc3ccccc23)C1=O
Show InChI InChI=1S/C25H27N3O3/c1-17(19-11-12-19)27(15-18-7-3-2-4-8-18)22(29)16-28-23(30)25(26-24(28)31)14-13-20-9-5-6-10-21(20)25/h2-10,17,19H,11-16H2,1H3,(H,26,31)/t17-,25-/m1/s1
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n/an/a 1.30E+4n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286458
PNG
(CHEMBL4170778)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3cc(CO)ccc23)C1=O
Show InChI InChI=1S/C26H29N3O4/c1-17(20-8-9-20)28(14-18-5-3-2-4-6-18)23(31)15-29-24(32)26(27-25(29)33)12-11-21-13-19(16-30)7-10-22(21)26/h2-7,10,13,17,20,30H,8-9,11-12,14-16H2,1H3,(H,27,33)
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n/an/a 1.40E+4n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286470
PNG
(CHEMBL4168882)
Show SMILES C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3cc(NS(C)(=O)=O)ccc23)C1=O
Show InChI InChI=1S/C26H30N4O5S/c1-17(19-8-9-19)29(15-18-6-4-3-5-7-18)23(31)16-30-24(32)26(27-25(30)33)13-12-20-14-21(10-11-22(20)26)28-36(2,34)35/h3-7,10-11,14,17,19,28H,8-9,12-13,15-16H2,1-2H3,(H,27,33)/t17-,26?/m0/s1
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n/an/a 1.60E+4n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286471
PNG
(CHEMBL4160552)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3c2cccc3C(N)=O)C1=O
Show InChI InChI=1S/C26H28N4O4/c1-16(18-10-11-18)29(14-17-6-3-2-4-7-17)22(31)15-30-24(33)26(28-25(30)34)13-12-19-20(23(27)32)8-5-9-21(19)26/h2-9,16,18H,10-15H2,1H3,(H2,27,32)(H,28,34)
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n/an/a 1.79E+4n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (Human))
BDBM50286423
PNG
(CHEMBL4174931)
Show SMILES CNC(=O)Nc1ccc2c(CC[C@@]22OC(=O)N(CC(=O)N(Cc3ccccc3)[C@@H](C)C(F)(F)F)C2=O)c1
Show InChI InChI=1S/C25H25F3N4O5/c1-15(25(26,27)28)31(13-16-6-4-3-5-7-16)20(33)14-32-21(34)24(37-23(32)36)11-10-17-12-18(8-9-19(17)24)30-22(35)29-2/h3-9,12,15H,10-11,13-14H2,1-2H3,(H2,29,30,35)/t15-,24+/m0/s1
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n/an/a 2.40E+4n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4 (unknown origin)


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair
CREB-binding protein/Histone acetyltransferase p300


(Homo sapiens (Human))
BDBM50286463
PNG
(CHEMBL4163946)
Show SMILES CC(C1CC1)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCc3c2cccc3C#N)C1=O
Show InChI InChI=1S/C26H26N4O3/c1-17(19-10-11-19)29(15-18-6-3-2-4-7-18)23(31)16-30-24(32)26(28-25(30)33)13-12-21-20(14-27)8-5-9-22(21)26/h2-9,17,19H,10-13,15-16H2,1H3,(H,28,33)
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n/an/a 2.78E+4n/an/an/an/an/an/a



AbbVie, Inc.

Curated by ChEMBL


Assay Description
Inhibition of p300/CBP (unknown origin) using biotinylated synthetic Histone H4 Peptide as substrate pretreated for 30 mins followed by substrate add...


ACS Med Chem Lett 9: 28-33 (2018)

More data for this
Ligand-Target Pair