| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L019181
BDB019181
|
US10711007, Example 87
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OCCc3cc(Cl)c(Cl)cc32)[C@@H](O)[C@H]1O
|
C20H19Cl2N3O4 436.295000 |
OGKDUZCIRBBSNS-ILRSOXBSSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453025; PubChem:CID139488374
|
Local ready
Direct docking supported
|
|
E3L019182
BDB019182
|
US10711007, Example 88
Nc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OCCc3cc(Cl)c(Cl)cc32)[C@@H](O)[C@H]1O
|
C19H18Cl2N4O4 437.283000 |
JZUYFQWEDPPVCE-IPXJXJKCSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453026; PubChem:CID139488299
|
Local ready
Direct docking supported
|
|
E3L019183
BDB019183
|
US10711007, Example 89
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OCCc3cc(Cl)sc32)[C@@H](O)[C@H]1O
|
C18H18ClN3O4S 407.879000 |
RGEFRBMOBQDZBB-SFUJAXRZSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453027; PubChem:CID139488426
|
Local ready
Direct docking supported
|
|
E3L019184
BDB019184
|
US10711007, Example 90
Nc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OCCc3cc(Cl)sc32)[C@@H](O)[C@H]1O
|
C17H17ClN4O4S 408.867000 |
OYPQTNGMDHACTQ-NLLNSEBYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453028; PubChem:CID139488431
|
Local ready
Direct docking supported
|
|
E3L019185
BDB019185
|
US10711007, Example 91
Nc1ncnc2c1ccn2[C@@H]1O[C@H]([C@H]2OCCc3cc(Cl)sc32)[C@@H](O)[C@H]1O
|
C17H17ClN4O4S 408.867000 |
OYPQTNGMDHACTQ-PBXXVYOESA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453029; PubChem:CID139488556
|
Local ready
Direct docking supported
|
|
E3L019186
BDB019186
|
US10711007, Example 92
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OC[C@@H](F)c3cc(Cl)ccc32)[C@@H](O)[C@H]1O
|
C20H19ClFN3O4 419.840000 |
OWCCWTKMNKIDAJ-PPSVVTBLSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453030; PubChem:CID139488184
|
Local ready
Direct docking supported
|
|
E3L019187
BDB019187
|
US10711007, Example 93
Nc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OC[C@@H](F)c3cc(Cl)ccc32)[C@@H](O)[C@H]1O
|
C19H18ClFN4O4 420.828000 |
BDWOIRAPZCUKDY-XPYFFNBCSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453031; PubChem:CID139488573
|
Local ready
Direct docking supported
|
|
E3L019188
BDB019188
|
US10711007, Example 94
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OC[C@H](F)c3cc(Cl)ccc32)[C@@H](O)[C@H]1O
|
C20H19ClFN3O4 419.840000 |
OWCCWTKMNKIDAJ-QMWWYVJASA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453032; PubChem:CID139488171
|
Local ready
Direct docking supported
|
|
E3L019189
BDB019189
|
US10711007, Example 95
Nc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OC[C@H](F)c3cc(Cl)ccc32)[C@@H](O)[C@H]1O
|
C19H18ClFN4O4 420.828000 |
BDWOIRAPZCUKDY-CFALAGKBSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453033; PubChem:CID139488641
|
Local ready
Direct docking supported
|
|
E3L019190
BDB019190
|
US10711007, Example 97
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2OCOc3c2ccc(F)c3F)[C@@H](O)[C@H]1O
|
C19H17F2N3O5 405.357000 |
KFFJVMZXYDPIDQ-XMJRAMJNSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453034; PubChem:CID139488666
|
Local ready
Direct docking supported
|
|
E3L019191
BDB019191
|
US10711007, Example 98
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@@H]2NCCc3cc(Cl)ccc32)[C@@H](O)[C@H]1O
|
C20H21ClN4O3 400.866000 |
WZUPWIUCGGYCAP-KWXDATOUSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453035; PubChem:CID139488365
|
Local ready
Direct docking supported
|
|
E3L019192
BDB019192
|
US10711007, Example 99
Cc1cc2c(cc1Cl)CCO[C@H]2[C@H]1O[C@@H](n2ccc3c(C)ncnc32)[C@H](O)[C@@H]1O
|
C21H22ClN3O4 415.877000 |
CGYBTANMJBGPQQ-KWLWEVDOSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453036; PubChem:CID139488602
|
Local ready
Direct docking supported
|
|
E3L019193
BDB019193
|
US10711007, Example 100
Cc1cc2c(cc1Cl)CCO[C@H]2[C@H]1O[C@@H](n2ccc3c(N)ncnc32)[C@H](O)[C@@H]1O
|
C20H21ClN4O4 416.865000 |
WGKVJYZNSMWPLN-HAJKQMQPSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM453037; PubChem:CID139488248
|
Local ready
Direct docking supported
|
|
E3L019194
BDB019194
|
US10717742, Example Ia-20
COC(=O)c1ccc2c3n(nc2c1C)[C@@H]1[C@H](C3)N(CC2CC2)[C@@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
|
C32H27Cl2FN4O3 605.497000 |
IDSWKGDCGKUZNN-NWFGXUQWSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM454207; PubChem:CID129029064
|
Local ready
Direct docking supported
|
|
E3L019195
BDB019195
|
US10717742, Example Ia-25
O=C(O)c1ccc2c3n(nc2c1)[C@@H]1[C@H](C3)N(CC2CC2)[C@@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
|
C30H23Cl2FN4O3 577.443000 |
IJESPKAZVNRIFC-VBVRERCOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM454369; PubChem:CID129264131
|
Local ready
Direct docking supported
|
|
E3L019196
BDB019196
|
US10717742, Example Ia-26
O=C(O)c1ccc2c3n(nc2c1)[C@@H]1[C@H](C3)N(CC2CCC2)[C@@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
|
C31H25Cl2FN4O3 591.470000 |
AEQUTRHRIIGVSE-OCCLXFBYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM454370; PubChem:CID129264132
|
Local ready
Direct docking supported
|
|
E3L019197
BDB019197
|
US10717742, Example Ia-27
CC(C)CN1[C@H]2Cc3c4ccc(C(=O)O)cc4nn3[C@H]2[C@H](c2cccc(Cl)c2F)[C@]12C(=O)Nc1cc(Cl)ccc12
|
C30H25Cl2FN4O3 579.459000 |
LQOGSDFKCQZUQP-VBVRERCOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM454371; PubChem:CID129264133
|
Local ready
Direct docking supported
|
|
E3L019198
BDB019198
|
US10717742, Example Ia-29
CCCN1[C@H]2Cc3c4ccc(C(=O)O)cc4nn3[C@H]2[C@H](c2cccc(Cl)c2F)[C@]12C(=O)Nc1cc(Cl)ccc12
|
C29H23Cl2FN4O3 565.432000 |
LPHOAUWAKBYMBO-KZXHITELSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM454372; PubChem:CID129264135
|
Local ready
Direct docking supported
|
|
E3L019199
BDB019199
|
US10717742, Example Ia-30
CCN1[C@H]2Cc3c4ccc(C(=O)O)cc4nn3[C@H]2[C@H](c2cccc(Cl)c2F)[C@]12C(=O)Nc1cc(Cl)ccc12
|
C28H21Cl2FN4O3 551.405000 |
MNPCPZFFXZLCLX-BKQUXSEHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM454373; PubChem:CID129264136
|
Local ready
Direct docking supported
|
|
E3L019200
BDB019200
|
US10717742, Example Ia-31
COCCN1[C@H]2Cc3c4ccc(C(=O)O)cc4nn3[C@H]2[C@H](c2cccc(Cl)c2F)[C@]12C(=O)Nc1cc(Cl)ccc12
|
C29H23Cl2FN4O4 581.431000 |
TYEKGVKGHKBPIA-KZXHITELSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM454375; PubChem:CID129264137
|
Local ready
Direct docking supported
|