| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L011101
BDB011101
|
BDBM227742
CCCCCN(C)c1nc(C(=O)O)nc2nc(-c3cccc(C)c3)n(Cc3ccc(C(F)(F)F)cc3)c12
|
C27H28F3N5O2 511.548000 |
QFYWQZNCIYKUCM-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM227742; PubChem:CID90318316
|
Local ready
Direct docking supported
|
|
E3L011102
BDB011102
|
BDBM227743
Cc1cccc(-c2nc3nc(C(=O)O)nc(N4CCCC4C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C29H28F3N5O2 535.570000 |
YJKYVHSYOAOEFI-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM227743; PubChem:CID90317726
|
Local ready
Direct docking supported
|
|
E3L011103
BDB011103
|
BDBM227744
Cc1cccc(-c2nc3nc(C(=O)O)nc(N4CCC4C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C28H26F3N5O2 521.543000 |
MCNCBYLYIRFVBE-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM227744; PubChem:CID90318479
|
Local ready
Direct docking supported
|
|
E3L011104
BDB011104
|
Mitoglitazone
CCc1ccc(C(=O)COc2ccc(CC3SC(=O)NC3=O)cc2)nc1
|
C19H18N2O4S 370.430000 |
IRNJSRAGRIZIHD-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM228129; PubChem:CID10429242
|
Local ready
Direct docking supported
|
|
E3L011105
BDB011105
|
BDBM228130
Nc1cc(C(F)(F)F)c(-c2nc(N3CCOCC3)c3c(n2)N2CCOC[C@H]2C3)cn1
|
C19H21F3N6O2 422.411000 |
VEUJAZRDHNBJQE-LLVKDONJSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM228130; PubChem:CID118000135
|
Local ready
Direct docking supported
|
|
E3L011106
BDB011106
|
BDBM228152
Nc1ncc(-c2nc(N3CCOCC3)c3c(n2)N2CCOC[C@H]2C3)cn1
|
C17H21N7O2 355.402000 |
WLHXVOYGBREFJO-GFCCVEGCSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM228152; PubChem:CID118000155
|
Local ready
Direct docking supported
|
|
E3L011107
BDB011107
|
BDBM228153
Nc1cc(C(F)(F)F)c(-c2nc(N3CCOCC3)c3c(n2)N2CCOC[C@@H]2C3)cn1
|
C19H21F3N6O2 422.411000 |
VEUJAZRDHNBJQE-NSHDSACASA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM228153; PubChem:CID118000139
|
Local ready
Direct docking supported
|
|
E3L011108
BDB011108
|
BDBM228154
Nc1ncc(-c2nc(N3CCOCC3)c3c(n2)N2CCOC[C@@H]2C3)cn1
|
C17H21N7O2 355.402000 |
WLHXVOYGBREFJO-LBPRGKRZSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM228154; PubChem:CID91668221
|
Local ready
Direct docking supported
|
|
E3L011109
BDB011109
|
BDBM228156
Nc1ncc(-c2nc(N3CCOCC3)nc3c2C[C@@H]2COCCN32)cn1
|
C17H21N7O2 355.402000 |
KDKHUZABTIJMDY-GFCCVEGCSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM228156; PubChem:CID118000151
|
Local ready
Direct docking supported
|
|
E3L011110
BDB011110
|
BDBM228158
Nc1ncc(-c2nc(N3CCOCC3)nc3c2C[C@H]2COCCN32)cn1
|
C17H21N7O2 355.402000 |
KDKHUZABTIJMDY-LBPRGKRZSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM228158; PubChem:CID118000048
|
Local ready
Direct docking supported
|
|
E3L011111
BDB011111
|
BDBM228590
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNC(=O)c1ccccc1)C(C)C
|
C24H31N5O3 437.544000 |
RJWKBXICIIIARA-VDGAXYAQSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228590; PubChem:CID76902766
|
Local ready
Direct docking supported
|
|
E3L011112
BDB011112
|
BDBM228591
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNC(C)=O)C(C)C
|
C19H29N5O3 375.473000 |
SHSNGKZXZBGSLA-RCBQFDQVSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228591; PubChem:CID117888130
|
Local ready
Direct docking supported
|
|
E3L011113
BDB011113
|
BDBM228592
CNC(=O)NC[C@@H]1Cc2cccnc2N1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C
|
C19H30N6O3 390.488000 |
DNDOKHQQWLFLBD-QEJZJMRPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228592; PubChem:CID117888137
|
Local ready
Direct docking supported
|
|
E3L011114
BDB011114
|
BDBM228593
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNC(=O)Cc1ccccc1)C(C)C
|
C25H33N5O3 451.571000 |
XFVQREUYFZAMJL-XJABCFGWSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228593; PubChem:CID73777099
|
Local ready
Direct docking supported
|
|
E3L011115
BDB011115
|
BDBM228594
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNC(=O)OC)C(C)C
|
C19H29N5O4 391.472000 |
ZDWCGZXOBQMPMU-QEJZJMRPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228594; PubChem:CID73777124
|
Local ready
Direct docking supported
|
|
E3L011116
BDB011116
|
BDBM228595
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNC(=O)N(C)C)C(C)C
|
C20H32N6O3 404.515000 |
WZRSIBRMVURXEQ-BPUTZDHNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228595; PubChem:CID73777101
|
Local ready
Direct docking supported
|
|
E3L011117
BDB011117
|
BDBM228596
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNC(=O)Nc1ccccc1)C(C)C
|
C24H32N6O3 452.559000 |
QTCYNUCDNBZLFI-VDGAXYAQSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228596; PubChem:CID73777103
|
Local ready
Direct docking supported
|
|
E3L011118
BDB011118
|
BDBM228597
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNC(=O)[C@@H](C)c1ccccc1)C(C)C
|
C26H35N5O3 465.598000 |
HAXZTIUXLDHRTE-GPHNJDIKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228597; PubChem:CID127053762
|
Local ready
Direct docking supported
|
|
E3L011119
BDB011119
|
BDBM228598
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNS(C)(=O)=O)C(C)C
|
C18H29N5O4S 411.528000 |
AQPFZOROSFELID-QEJZJMRPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228598; PubChem:CID73777107
|
Local ready
Direct docking supported
|
|
E3L011120
BDB011120
|
BDBM228599
CN[C@@H](C)C(=O)N[C@H](C(=O)N1c2ncccc2C[C@H]1CNS(=O)(=O)c1ccccc1)C(C)C
|
C23H31N5O4S 473.599000 |
YEKKUTCQUXWIQW-QRFRQXIXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM228599; PubChem:CID73777109
|
Local ready
Direct docking supported
|