| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L056861
BDB056861
|
BDBM50453822
C=CC(=O)Nc1ccc(C(=O)Nc2ccc(Nc3ncc4c(n3)N(C)c3ccc(C)cc3C(=O)N4C)cc2)cc1
|
C30H27N7O3 533.592000 |
CPKWRHVMDOSXKE-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM50453822; PubChem:CID134153498
|
Local ready
Direct docking supported
|
|
E3L056862
BDB056862
|
BDBM50453917
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC/C=C/CCC[C@@](C)(C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC1=O)[C@@H](C)O
|
C99H153N21O27 2069.433000 |
YOLLBQVCQMKTEN-AGFCONSFSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50453917
|
Local ready
Direct docking supported
|
|
E3L056863
BDB056863
|
BDBM50453948
CC(=O)N1CCc2c(c(-c3cccc4cc(-c5cnn(C)c5C#N)ncc34)nn2C2CCOCC2)C1
|
C27H27N7O2 481.560000 |
IGTVRCMVWVWOGL-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453948; PubChem:CID132186890
|
Local ready
Direct docking supported
|
|
E3L056864
BDB056864
|
BDBM50453949
CNC(=O)c1ccc(-c2cc3cccc(-c4nn(C5CCOCC5)c5c4CN(C(C)=O)CC5)c3cn2)cn1
|
C29H30N6O3 510.598000 |
MUJXZEDIWKGKQD-UHFFFAOYSA-N | O15164, Q09472, Q12830, Q92793, Q92831 | Transcription intermediary factor 1-alpha, CREB-binding protein, Histone acetyltransferase KAT2B, Histone acetyltransferase p300, Nucleosome-remodeling factor subunit BPTF |
BindingDB, PubChem
BindingDB:BDBM50453949; PubChem:CID132186469
|
Local ready
Direct docking supported
|
|
E3L056865
BDB056865
|
BDBM50453950
CC(=O)N1CCc2c(c(-c3cccc4cc(-c5cnn(C)c5)ncc34)nn2C2CCOCC2)C1
|
C26H28N6O2 456.550000 |
RPDQYBNAJDAGIK-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453950; PubChem:CID132186523
|
Local ready
Direct docking supported
|
|
E3L056866
BDB056866
|
BDBM50453951
CC(=O)N1CCc2c(c(-c3cccc4c3CC(=O)NC4)nn2C2CCOCC2)C1
|
C22H26N4O3 394.475000 |
VHDHDYHHHUDYMV-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453951; PubChem:CID139382567
|
Local ready
Direct docking supported
|
|
E3L056867
BDB056867
|
BDBM50453952
CC(=O)N1CCc2c(c(-c3ccc(CO)c4ccncc34)nn2C2CCOCC2)C1
|
C23H26N4O3 406.486000 |
UHNWSNQEYDVJCQ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453952; PubChem:CID132186467
|
Local ready
Direct docking supported
|
|
E3L056868
BDB056868
|
BDBM50453953
CC(=O)N1CCc2c(c(-c3ccc(C)c4ccncc34)nn2C2CCOCC2)C1
|
C23H26N4O2 390.487000 |
YMJZTJARHXMQNO-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453953; PubChem:CID132186772
|
Local ready
Direct docking supported
|
|
E3L056869
BDB056869
|
BDBM50453954
CC(=O)N1CCc2c(c(-c3cccc4c[nH]c(=O)cc34)nn2C2CCOCC2)C1
|
C22H24N4O3 392.459000 |
YKJKWNGJFSTOKG-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453954; PubChem:CID132186706
|
Local ready
Direct docking supported
|
|
E3L056870
BDB056870
|
BDBM50453955
CC(=O)N1CCc2c(c(-c3cccc4[nH]ccc34)nn2CC2CC2)C1
|
C20H22N4O 334.423000 |
MPXKOIKIRQBXKT-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453955; PubChem:CID132186817
|
Local ready
Direct docking supported
|
|
E3L056871
BDB056871
|
BDBM50453956
CCc1cc(-c2nn(C3CCOCC3)c3c2CN(C(C)=O)CC3)c2cnccc2c1
|
C24H28N4O2 404.514000 |
MUSHSSGZXVTTRI-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453956; PubChem:CID132169133
|
Local ready
Direct docking supported
|
|
E3L056872
BDB056872
|
BDBM50453957
CNC(=O)N1CCc2c(c(-c3cccc4cc(-c5cnn(C)c5)c(C(F)F)cc34)nn2C2CCOCC2)C1
|
C28H30F2N6O2 520.584000 |
KYSBIBBIUAZJKR-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453957; PubChem:CID145972623
|
Local ready
Direct docking supported
|
|
E3L056873
BDB056873
|
BDBM50453958
COc1cncc2c(-c3nn(C4CCOCC4)c4c3CN(C(C)=O)CC4)cccc12
|
C23H26N4O3 406.486000 |
GAVVBDXGDAIREU-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453958; PubChem:CID132186767
|
Local ready
Direct docking supported
|
|
E3L056874
BDB056874
|
BDBM50453959
CC(=O)N1CCc2c(c(-c3ccnc4ccccc34)nn2C2CCOCC2)C1
|
C22H24N4O2 376.460000 |
BGBBSIXSMDQYCB-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453959; PubChem:CID132186514
|
Local ready
Direct docking supported
|
|
E3L056875
BDB056875
|
BDBM50453960
CC(=O)N1CCc2c(c(-c3c[nH]c4ccccc34)nn2C2CCOCC2)C1
|
C21H24N4O2 364.449000 |
VEGQMQNNMPHWTC-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453960; PubChem:CID137250528
|
Local ready
Direct docking supported
|
|
E3L056876
BDB056876
|
BDBM50453961
CC(=O)N1CCc2c(c(-c3cccc4ccncc34)nn2C2CCOCC2)C1
|
C22H24N4O2 376.460000 |
HWMVZUDOEQIIJA-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453961; PubChem:CID132186586
|
Local ready
Direct docking supported
|
|
E3L056877
BDB056877
|
BDBM50453962
CC(=O)N1CCc2c(c(-c3cncc4ccccc34)nn2C2CCOCC2)C1
|
C22H24N4O2 376.460000 |
NAEZVAXBVFHAKF-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453962; PubChem:CID132169466
|
Local ready
Direct docking supported
|
|
E3L056878
BDB056878
|
BDBM50453963
CC(=O)N1CCc2c(c(-c3cccc4c(Cl)cncc34)nn2C2CCOCC2)C1
|
C22H23ClN4O2 410.905000 |
QRHSMFNSBKWHNZ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453963; PubChem:CID132169416
|
Local ready
Direct docking supported
|
|
E3L056879
BDB056879
|
BDBM50453964
CCc1cncc2c(-c3nn(C4CCOCC4)c4c3CN(C(C)=O)CC4)cccc12
|
C24H28N4O2 404.514000 |
IIKPEYATRJQMQZ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453964; PubChem:CID132186451
|
Local ready
Direct docking supported
|
|
E3L056880
BDB056880
|
BDBM50453965
CCc1ccc(-c2nn(C3CCOCC3)c3c2CN(C(C)=O)CC3)c2cnccc12
|
C24H28N4O2 404.514000 |
LDVUEFAKDIGXQX-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50453965; PubChem:CID132186468
|
Local ready
Direct docking supported
|