| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L017841
BDB017841
|
US10501467, Example 22
CC1C2=C3C(=NNC(=O)c4cccc1c43)CCC2
|
C15H14N2O 238.290000 |
HNRRRPQBLZKSPF-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM423416; PubChem:CID137422000
|
Local ready
Direct docking supported
|
|
E3L017842
BDB017842
|
BDBM423456
CC(N1CC2=NNC(=O)c3cccc4[nH]c(c2c34)C1)C(C)(C)N
|
C17H21N5O 311.389000 |
UFDIRFJWPGCILC-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM423456; PubChem:CID137421994
|
Local ready
Direct docking supported
|
|
E3L017843
BDB017843
|
BDBM424931
O=C1Nc2cn(C3CCOCC3)nc2C(=O)NCC(O)COc2ccc(=O)n(n2)Cc2cccc1n2
|
C23H25N7O6 495.496000 |
KMOSRUDBPHUJJQ-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM424931; PubChem:CID129265101
|
Local ready
Direct docking supported
|
|
E3L017844
BDB017844
|
US10544132, Example 1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C29H29Cl2NO4 526.460000 |
KWVOGOFTJBHEAY-GDLZYMKVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427023; PubChem:CID135281635
|
Local ready
Direct docking supported
|
|
E3L017845
BDB017845
|
US10544132, Example 2
CC(C)(O)c1cc(F)c2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C29H28Cl2FNO4 544.450000 |
QUBUREFIXVDKEB-GDLZYMKVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427047; PubChem:CID135281669
|
Local ready
Direct docking supported
|
|
E3L017846
BDB017846
|
US10544132, Example 3
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCCO)c1ccc(Cl)cc1
|
C26H25Cl2NO4 486.395000 |
BDOTXISZENQYGP-AREMUKBSSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427048; PubChem:CID135281430
|
Local ready
Direct docking supported
|
|
E3L017847
BDB017847
|
US10544132, Example 4
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)COC1)c1ccc(Cl)cc1
|
C29H29Cl2NO5 542.459000 |
GDUHFOYTYPKEOT-GDLZYMKVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427049; PubChem:CID135281482
|
Local ready
Direct docking supported
|
|
E3L017848
BDB017848
|
US10544132, Example 5
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(C(=O)O)CC1)c1ccc(Cl)cc1
|
C29H27Cl2NO5 540.443000 |
IAJLMKLNFWIPMA-GDLZYMKVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427050; PubChem:CID135281515
|
Local ready
Direct docking supported
|
|
E3L017849
BDB017849
|
US10544132, Example 6
C[C@@H](c1ccc(Cl)cc1)N1C(=O)c2cc(C(C)(C)O)ccc2[C@]1(OCC(C)(O)CO)c1ccc(Cl)cc1
|
C29H31Cl2NO5 544.475000 |
UUZINBSIYDKSFT-PDIMESBLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427051; PubChem:CID135281509
|
Local ready
Direct docking supported
|
|
E3L017850
BDB017850
|
US10544132, Example 7
C[C@@H](c1ccc(Cl)cc1)N1C(=O)c2cc(C(C)(C)O)ccc2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C30H31Cl2NO4 540.487000 |
OBIKGGOHRXESCS-WWOZWPLTSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427053; PubChem:CID135281662
|
Local ready
Direct docking supported
|
|
E3L017851
BDB017851
|
US10544132, Example 8
C[C@](O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C29H29Cl2NO5 542.459000 |
NVLQHQFGNPTQCC-LMSSTIIKSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427054; PubChem:CID154732949
|
Local ready
Direct docking supported
|
|
E3L017852
BDB017852
|
US10544132, Example 9
C[C@@](O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C29H29Cl2NO5 542.459000 |
NVLQHQFGNPTQCC-XRKRLSELSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427055; PubChem:CID154732950
|
Local ready
Direct docking supported
|
|
E3L017853
BDB017853
|
US10544132, Example 10
COC[C@](C)(O)c1ccc2c(c1)C(=O)N([C@@H](C)c1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C31H33Cl2NO5 570.513000 |
UIFBZUZURMPJLE-CRIGUBNMSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427056; PubChem:CID154732951
|
Local ready
Direct docking supported
|
|
E3L017854
BDB017854
|
US10544132, Example 11
COC[C@@](C)(O)c1ccc2c(c1)C(=O)N([C@@H](C)c1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C31H33Cl2NO5 570.513000 |
UIFBZUZURMPJLE-XCIXRLFOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427057; PubChem:CID154732952
|
Local ready
Direct docking supported
|
|
E3L017855
BDB017855
|
US10544132, Example 12
CN(C)C[C@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C31H34Cl2N2O4 569.529000 |
FLSKRFKVCWLISS-IGYGKHONSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427058; PubChem:CID154732953
|
Local ready
Direct docking supported
|
|
E3L017856
BDB017856
|
US10544132, Example 13
CN(C)C[C@@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C31H34Cl2N2O4 569.529000 |
FLSKRFKVCWLISS-BVRKHOPBSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427060; PubChem:CID154732954
|
Local ready
Direct docking supported
|
|
E3L017857
BDB017857
|
US10544132, Example 14
CC(C)(O)c1ccc2c(c1)C(=O)N([C@@H](CC(=O)O)c1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C31H31Cl2NO6 584.496000 |
ZJSPHSZNTWLUQB-SUYBVONHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427061; PubChem:CID137405302
|
Local ready
Direct docking supported
|
|
E3L017858
BDB017858
|
US10544132, Example 15
C[C@@H](c1ccc(Cl)cc1)N1C(=O)c2cc(C(C)(O)CO)ccc2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1
|
C30H31Cl2NO5 556.486000 |
HLYNUXSLMMUNHC-WDWHWGHSSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427062; PubChem:CID135281406
|
Local ready
Direct docking supported
|
|
E3L017859
BDB017859
|
US10544132, Example 16
CC(C)(O)CCO[C@]1(c2ccc(Cl)cc2)c2ccc(C(C)(C)O)cc2C(=O)N1Cc1ccc(Cl)cc1
|
C29H31Cl2NO4 528.476000 |
QFAIKCYCAGIEDP-GDLZYMKVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427063; PubChem:CID135281465
|
Local ready
Direct docking supported
|
|
E3L017860
BDB017860
|
US10544132, Example 17
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)C2(OCc1cn[nH]c1)c1ccc(Cl)cc1
|
C28H25Cl2N3O3 522.432000 |
COYLYTVXALVFKT-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM427064; PubChem:CID142440544
|
Local ready
Direct docking supported
|