| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L024441
BDB024441
|
US11274090, Example 149 Isomer 2
Cn1cc(-c2ccc(NC(=O)[C@H](NCC(c3ccc(C#N)cc3)C(F)(F)F)c3ccccc3)nc2)cn1
|
C27H23F3N6O 504.516000 |
OOKDMDYSGMQNGA-XSWBTSGESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542429; PubChem:CID164515114
|
Local ready
Direct docking supported
|
|
E3L024442
BDB024442
|
US11274090, Example 150 Isomer 1
Cc1ncc([C@@H](C)CN[C@@H](C(=O)Nc2ccc(-c3cnn(C)c3)cn2)c2ccccc2)cn1
|
C25H27N7O 441.539000 |
DGZWMXHKVDYLPU-BXKMTCNYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542432; PubChem:CID156293404
|
Local ready
Direct docking supported
|
|
E3L024443
BDB024443
|
US11274090, Example 150 Isomer 2
Cc1ncc([C@H](C)CN[C@@H](C(=O)Nc2ccc(-c3cnn(C)c3)cn2)c2ccccc2)cn1
|
C25H27N7O 441.539000 |
DGZWMXHKVDYLPU-MZNJEOGPSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542433; PubChem:CID156293403
|
Local ready
Direct docking supported
|
|
E3L024444
BDB024444
|
US11274090, Example 150 Isomer 3
Cc1ncc([C@@H](C)CN[C@H](C(=O)Nc2ccc(-c3cnn(C)c3)cn2)c2ccccc2)cn1
|
C25H27N7O 441.539000 |
DGZWMXHKVDYLPU-XDHUDOTRSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542434; PubChem:CID139426157
|
Local ready
Direct docking supported
|
|
E3L024445
BDB024445
|
US11274090, Example 150 Isomer 4
Cc1ncc([C@H](C)CN[C@H](C(=O)Nc2ccc(-c3cnn(C)c3)cn2)c2ccccc2)cn1
|
C25H27N7O 441.539000 |
DGZWMXHKVDYLPU-OSPHWJPCSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542435; PubChem:CID139426154
|
Local ready
Direct docking supported
|
|
E3L024446
BDB024446
|
US11274090, Example 151 Isomer 1
Cn1cc(-c2ccc3c(c2)CCCN3C(=O)[C@@H](NCCc2ccc(C#N)cc2)c2ccccc2)cn1
|
C30H29N5O 475.596000 |
UDCVHWNHBVZORU-LJAQVGFWSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542436; PubChem:CID139426152
|
Local ready
Direct docking supported
|
|
E3L024447
BDB024447
|
US11274090, Example 152 Isomer 1
Cn1cc(-c2ccc3c(c2)CCN3C(=O)[C@@H](NCCc2ccc(C#N)cc2)c2ccccc2)cn1
|
C29H27N5O 461.569000 |
PLIOUZZJBKYIKV-NDEPHWFRSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542438; PubChem:CID139426153
|
Local ready
Direct docking supported
|
|
E3L024448
BDB024448
|
US11274090, Example 153 Isomer 1
NS(=O)(=O)c1ccc(CCN[C@@H](C(=O)N2CCc3ccccc32)c2ccccc2)cc1
|
C24H25N3O3S 435.549000 |
ZNDOJMRQYRETAN-HSZRJFAPSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542440; PubChem:CID155776240
|
Local ready
Direct docking supported
|
|
E3L024449
BDB024449
|
US11274090, Example 153 Isomer 2
NS(=O)(=O)c1ccc(CCN[C@H](C(=O)N2CCc3ccccc32)c2ccccc2)cc1
|
C24H25N3O3S 435.549000 |
ZNDOJMRQYRETAN-QHCPKHFHSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542441; PubChem:CID139426170
|
Local ready
Direct docking supported
|
|
E3L024450
BDB024450
|
US11274090, Example 154-racemic
NS(=O)(=O)c1ccc(CCNC(C(=O)N2CCCc3ccccc32)c2ccccc2)cc1
|
C25H27N3O3S 449.576000 |
ZJNNQBLQTCZIAA-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542442; PubChem:CID139426194
|
Local ready
Direct docking supported
|
|
E3L024451
BDB024451
|
US11274098, Example 1
CN1CCN(c2nc(NC3CCC3)cc(C(=O)NCC(O)CN3CCc4[nH]c5ccccc5c4C3)n2)CC1
|
C28H38N8O2 518.666000 |
UFBDGQMBYWJUOT-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542487; PubChem:CID135330765
|
Local ready
Direct docking supported
|
|
E3L024452
BDB024452
|
US11274098, Example 2
CN1CCN(c2cc(C(=O)NCC(O)CN3CCc4[nH]c5ccccc5c4C3)cc(NC3CCC3)n2)CC1
|
C29H39N7O2 517.678000 |
IOXCOBDKZWKUOO-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542488; PubChem:CID135330764
|
Local ready
Direct docking supported
|
|
E3L024453
BDB024453
|
US11274098, Example 3
O=C(NCC(O)CN1CCc2[nH]c3ccccc3c2C1)c1cc(NC2CCC2)ncn1
|
C23H28N6O2 420.517000 |
XFGGRVYEXSACGG-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542489; PubChem:CID142428465
|
Local ready
Direct docking supported
|
|
E3L024454
BDB024454
|
US11274098, Example 4
CC(=O)N1CCC(Nc2cc(C(=O)NCC(O)CN3CCc4[nH]c5ccccc5c4C3)ncn2)CC1
|
C26H33N7O3 491.596000 |
DOYGOTRVQLQXSK-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542490; PubChem:CID135331024
|
Local ready
Direct docking supported
|
|
E3L024455
BDB024455
|
US11274098, Example 5
O=C(NCC(O)CN1CCc2[nH]c3ccccc3c2C1)c1ccc(C(=O)N2C3CCC2COC3)cc1
|
C28H32N4O4 488.588000 |
CTSDFYHWEZHHFR-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542491; PubChem:CID142428435
|
Local ready
Direct docking supported
|
|
E3L024456
BDB024456
|
US11274098, Example 6
CN1CCN(c2nc(NC3CCC3)cc(C(=O)NCC(O)CN3CCc4c(c5ccccc5n4C)C3)n2)CC1
|
C29H40N8O2 532.693000 |
LBLZEQOHSQDSPR-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542492; PubChem:CID135330858
|
Local ready
Direct docking supported
|
|
E3L024457
BDB024457
|
US11274098, Example 7
CN1CCN(c2cc(C(=O)NCC(O)CN3CCc4c(c5ccccc5n4C)C3)cc(NC3CCC3)n2)CC1
|
C30H41N7O2 531.705000 |
ZFSDSIOPSHYGLF-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542493; PubChem:CID135331590
|
Local ready
Direct docking supported
|
|
E3L024458
BDB024458
|
US11274098, Example 8
Cn1c2c(c3ccccc31)CN(CC(O)CNC(=O)c1ccc(C(=O)N3C4CCC3COC4)cc1)CC2
|
C29H34N4O4 502.615000 |
BMVWYOJMXCGYLS-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542494; PubChem:CID142428436
|
Local ready
Direct docking supported
|
|
E3L024459
BDB024459
|
US11274098, Example 9
CN1CCN(c2nc(NC3CCC3)cc(C(=O)NCC(O)CN3CCc4c([nH]c5ccccc45)C3)n2)CC1
|
C28H38N8O2 518.666000 |
CCWDVVMHKNOXPU-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542495; PubChem:CID135331056
|
Local ready
Direct docking supported
|
|
E3L024460
BDB024460
|
US11274098, Example 10
CN1CCN(c2cc(C(=O)NCC(O)CN3CCc4c([nH]c5ccccc45)C3)cc(NC3CCC3)n2)CC1
|
C29H39N7O2 517.678000 |
KZVDWPDFXBFKKB-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542496; PubChem:CID135330878
|
Local ready
Direct docking supported
|