| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L033181
BDB033181
|
BDBM656661
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4ccccc4C)CO3)CC2)C1)C(C)C
|
C36H47FN6O5S 694.874000 |
OAKWYTFVNHTJMR-WDYNHAJCSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656661
|
Local ready
Direct docking supported
|
|
E3L033182
BDB033182
|
BDBM656662
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4cccc(Cl)c4)CO3)CC2)C1)C(C)C
|
C35H44ClFN6O5S 715.292000 |
MQNWXWHTPXDRIC-IZLXSDGUSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656662
|
Local ready
Direct docking supported
|
|
E3L033183
BDB033183
|
BDBM656663
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4ccccn4)CO3)CC2)C1)C(C)C
|
C34H44FN7O5S 681.835000 |
LDSXVWIYYOLRKK-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656663
|
Local ready
Direct docking supported
|
|
E3L033184
BDB033184
|
BDBM656664
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4ccccc4Cl)CO3)CC2)C1)C(C)C
|
C35H44ClFN6O5S 715.292000 |
YWLGNXAMQLWTIF-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656664
|
Local ready
Direct docking supported
|
|
E3L033185
BDB033185
|
BDBM656665
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4cccc(C)c4)CO3)CC2)C1)C(C)C
|
C36H47FN6O5S 694.874000 |
IBPAACUMKIFXGL-WDYNHAJCSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656665
|
Local ready
Direct docking supported
|
|
E3L033186
BDB033186
|
BDBM656666
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4ccc(Cl)cc4)CO3)CC2)C1)C(C)C
|
C35H44ClFN6O5S 715.292000 |
UDUJNFMQKOCLQP-IZLXSDGUSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656666
|
Local ready
Direct docking supported
|
|
E3L033187
BDB033187
|
BDBM656667
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4ccc(OC)cc4)CO3)CC2)C1)C(C)C
|
C36H47FN6O6S 710.873000 |
DDHHINABWCNZHV-PXJZQJOASA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656667
|
Local ready
Direct docking supported
|
|
E3L033188
BDB033188
|
BDBM656668
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4cccnc4)CO3)CC2)C1)C(C)C
|
C34H44FN7O5S 681.835000 |
APYDUTJOFFXKOO-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656668
|
Local ready
Direct docking supported
|
|
E3L033189
BDB033189
|
BDBM656669
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)N4CCOCC4)CO3)CC2)C1)C(C)C
|
C33H48FN7O6S 689.855000 |
JMJLORUCTIXUJJ-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656669
|
Local ready
Direct docking supported
|
|
E3L033190
BDB033190
|
BDBM656670
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4ccccc4OC)CO3)CC2)C1)C(C)C
|
C36H47FN6O6S 710.873000 |
HFNQVJDGJXHVSG-IZLXSDGUSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656670
|
Local ready
Direct docking supported
|
|
E3L033191
BDB033191
|
BDBM656671
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4cccc(OC)c4)CO3)CC2)C1)C(C)C
|
C36H47FN6O6S 710.873000 |
NXEWOXQXUQPWML-PXJZQJOASA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656671
|
Local ready
Direct docking supported
|
|
E3L033192
BDB033192
|
BDBM656672
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CCOCC4)CO3)CC2)C1)C(C)C
|
C34H49FN6O6S 688.867000 |
CDPFWXMOLMGLRB-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656672
|
Local ready
Direct docking supported
|
|
E3L033193
BDB033193
|
BDBM656673
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4cnn(C)c4)CO3)CC2)C1)C(C)C
|
C33H45FN8O5S 684.839000 |
YBDYEYUHPSXVRL-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656673
|
Local ready
Direct docking supported
|
|
E3L033194
BDB033194
|
BDBM656674
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)N4CCC4)CO3)CC2)C1)C(C)C
|
C32H46FN7O5S 659.829000 |
SDBYYYQVQSHOIZ-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656674
|
Local ready
Direct docking supported
|
|
E3L033195
BDB033195
|
BDBM656675
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)N4CC(F)(F)C4)CO3)CC2)C1)C(C)C
|
C32H44F3N7O5S 695.809000 |
HCBPPKPNVQERLC-RPBOFIJWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656675
|
Local ready
Direct docking supported
|
|
E3L033196
BDB033196
|
BDBM656676
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4csc(C)n4)CO3)CC2)C1)C(C)C
|
C33H44FN7O5S2 701.891000 |
KVIMAKVIWSHABY-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656676
|
Local ready
Direct docking supported
|
|
E3L033197
BDB033197
|
BDBM656677
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4cnc(C)o4)CO3)CC2)C1)C(C)C
|
C33H44FN7O6S 685.823000 |
NZPRSNWUJBNIIS-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656677
|
Local ready
Direct docking supported
|
|
E3L033198
BDB033198
|
BDBM656678
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(N)(=O)=O)CO3)CC2)C1)C(C)C
|
C29H42FN7O5S 619.764000 |
UPALCSXKKBSBRY-PKTZIBPZSA-N | Q03164 | Menin |
BindingDB, PubChem
BindingDB:BDBM656678; PubChem:CID166131454
|
Local ready
Direct docking supported
|
|
E3L033199
BDB033199
|
BDBM656679
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4ccc(=O)n(C)c4)CO3)CC2)C1)C(C)C
|
C35H46FN7O6S 711.861000 |
DOKJIGBMJZICDS-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656679
|
Local ready
Direct docking supported
|
|
E3L033200
BDB033200
|
BDBM656680
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)c4c[nH]c(=O)cc4C)CO3)CC2)C1)C(C)C
|
C35H46FN7O6S 711.861000 |
MDIUVXQMFKLJQJ-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656680
|
Local ready
Direct docking supported
|