| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L035621
BDB035621
|
BDBM710913
Cn1cnnc1[C@H](c1cccc(N2Cc3c(Cl)cc(CNC4(C)CCC4)cc3C2=O)c1)C1COC1
|
C27H30ClN5O2 492.023000 |
DSBDQQZXJGSZOC-XMMPIXPASA-N | Q13191 | Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710913; PubChem:CID168263073
|
Local ready
Direct docking supported
|
|
E3L035622
BDB035622
|
BDBM710914
Cn1cnnc1[C@]1(c2cccc(N3Cc4c(cc(CNC5(C)CCC5)cc4C(F)F)C3=O)c2)C[C@@H](F)C1
|
C28H30F3N5O 509.576000 |
WSJUWJIMIXGBMP-LBLBPIOVSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710914
|
Local ready
Direct docking supported
|
|
E3L035623
BDB035623
|
BDBM710915
Cn1cnnc1[C@]1(c2cccc(N3Cc4c(Cl)cc(CNC5(C)CCC5)cc4C3=O)c2)C[C@@H](F)C1
|
C27H29ClFN5O 494.014000 |
WRDBAVILVSZTIZ-GEQDBVPJSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710915
|
Local ready
Direct docking supported
|
|
E3L035624
BDB035624
|
BDBM710916
CCNc1cc([C@]2(c3nncn3C)C[C@@H](C)C2)cc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)F)C2=O)n1
|
C30H37F2N7O 549.670000 |
SIDDXBFGWXCHPV-GGCACFJLSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710916
|
Local ready
Direct docking supported
|
|
E3L035625
BDB035625
|
BDBM710917
Cn1cnnc1[C@H](C[C@@H]1CCOC1)c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1
|
C30H34F3N5O2 553.629000 |
WWULLPRVIKGCLF-WMZHIEFXSA-N | Q13191 | Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710917; PubChem:CID168262642
|
Local ready
Direct docking supported
|
|
E3L035626
BDB035626
|
BDBM710918
Cn1cnnc1[C@@H](C[C@@H]1CCOC1)c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1
|
C30H34F3N5O2 553.629000 |
WWULLPRVIKGCLF-CVDCTZTESA-N | Q13191 | Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710918; PubChem:CID168262850
|
Local ready
Direct docking supported
|
|
E3L035627
BDB035627
|
BDBM710919
Cn1cnnc1[C@@H](C[C@H]1CCOC1)c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1
|
C30H34F3N5O2 553.629000 |
WWULLPRVIKGCLF-XXBNENTESA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710919; PubChem:CID168262712
|
Local ready
Direct docking supported
|
|
E3L035628
BDB035628
|
BDBM710920
Cn1cnnc1[C@H](C[C@H]1CCOC1)c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1
|
C30H34F3N5O2 553.629000 |
WWULLPRVIKGCLF-AUSIDOKSSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710920; PubChem:CID168262508
|
Local ready
Direct docking supported
|
|
E3L035629
BDB035629
|
BDBM710921
Cn1cnnc1C1(c2cccc(N3Cc4c(cc(CNC5(C)CCC5)cc4C(F)(F)F)C3=O)c2)CCC1
|
C28H30F3N5O 509.576000 |
LRWRLTZIJZAZFD-UHFFFAOYSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710921; PubChem:CID168262826
|
Local ready
Direct docking supported
|
|
E3L035630
BDB035630
|
BDBM710922
Cn1cnnc1[C@]1(c2cccc(N3Cc4c(cc(CNC5(C)CCC5)cc4C(F)(F)F)C3=O)c2)C[C@H](OCC#N)C1
|
C30H31F3N6O2 564.612000 |
KPSDPUDIOPLZOR-JGCHJSNTSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710922
|
Local ready
Direct docking supported
|
|
E3L035631
BDB035631
|
BDBM710923
Cn1cnnc1[C@]1(c2cccc(N3Cc4c(cc(CNC5(C)CCC5)cc4C(F)(F)F)C3=O)c2)C[C@@H](OCC#N)C1
|
C30H31F3N6O2 564.612000 |
KPSDPUDIOPLZOR-FXBOJIBUSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710923
|
Local ready
Direct docking supported
|
|
E3L035632
BDB035632
|
BDBM710924
Cn1cnnc1C1(c2cccc(N3Cc4c(cc(CNC5(C)CCC5)cc4C(F)(F)F)C3=O)c2)CCOCC1
|
C29H32F3N5O2 539.602000 |
FKGIWCGGBHLFPS-UHFFFAOYSA-N | Q13191 | Tyrosine-protein kinase Lck, E3 ubiquitin-protein ligase CBL-B |
BindingDB, PubChem
BindingDB:BDBM710924; PubChem:CID168263113
|
Local ready
Direct docking supported
|
|
E3L035633
BDB035633
|
BDBM710925
Cn1cnnc1C1(c2cccc(N3Cc4c(cc(CNC5(C)CCC5)cc4C(F)(F)F)C3=O)c2)CC1
|
C27H28F3N5O 495.549000 |
RFYOGEYTLSCWFY-UHFFFAOYSA-N | Q13191 | Tyrosine-protein kinase Lck, E3 ubiquitin-protein ligase CBL-B |
BindingDB, PubChem
BindingDB:BDBM710925; PubChem:CID168835387
|
Local ready
Direct docking supported
|
|
E3L035634
BDB035634
|
BDBM710926
C[C@@H](NC1(C)CCC1)c1cc2c(c(C(F)(F)F)c1)CN(c1cccc(C(c3nncn3C)C3COC3)c1)C2=O
|
C29H32F3N5O2 539.602000 |
ITCYMXGHPXIVGP-SMFUYQKNSA-N | Q13191 | Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710926; PubChem:CID168262730
|
Local ready
Direct docking supported
|
|
E3L035635
BDB035635
|
BDBM710927
C[C@H](NC1(C)CCC1)c1cc2c(c(C(F)(F)F)c1)CN(c1cccc(C(c3nncn3C)C3COC3)c1)C2=O
|
C29H32F3N5O2 539.602000 |
ITCYMXGHPXIVGP-LFUZPPSTSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710927; PubChem:CID168262504
|
Local ready
Direct docking supported
|
|
E3L035636
BDB035636
|
BDBM710928
Cn1cnnc1[C@H](CC1CCS(=O)(=O)CC1)c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1
|
C31H36F3N5O3S 615.722000 |
LSBQIUVUFGLAJT-XMMPIXPASA-N | Q13191 | Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710928
|
Local ready
Direct docking supported
|
|
E3L035637
BDB035637
|
BDBM710929
Cn1cnnc1[C@@H](CC1CCS(=O)(=O)CC1)c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1
|
C31H36F3N5O3S 615.722000 |
LSBQIUVUFGLAJT-DEOSSOPVSA-N | Q13191 | Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710929
|
Local ready
Direct docking supported
|
|
E3L035638
BDB035638
|
BDBM710930
C[C@@H](NC1(C)CCC1)c1cc(Cl)c2c(c1)C(=O)N(c1cccc([C@]3(c4nncn4C)C[C@@H](F)C3)c1)C2
|
C28H31ClFN5O 508.041000 |
OHIWAMBAFXDJCL-KJFKMWBDSA-N | Q13191 | Tyrosine-protein kinase Lck, E3 ubiquitin-protein ligase CBL-B |
BindingDB
BindingDB:BDBM710930
|
Local ready
Direct docking supported
|
|
E3L035639
BDB035639
|
BDBM710931
C[C@H](NC1(C)CCC1)c1cc(Cl)c2c(c1)C(=O)N(c1cccc([C@]3(c4nncn4C)C[C@@H](F)C3)c1)C2
|
C28H31ClFN5O 508.041000 |
OHIWAMBAFXDJCL-CJBMVKJXSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B, Tyrosine-protein kinase Lck |
BindingDB
BindingDB:BDBM710931
|
Local ready
Direct docking supported
|
|
E3L035640
BDB035640
|
BDBM710932
Cn1cnnc1[C@@H](c1cccc(N2Cc3c(cc(CNC4(C)CCC4)cc3C(F)(F)F)C2=O)c1)C1CCOCC1
|
C30H34F3N5O2 553.629000 |
PJABFBSDQOHWAG-AREMUKBSSA-N | Q13191 | Tyrosine-protein kinase Lck |
BindingDB, PubChem
BindingDB:BDBM710932; PubChem:CID168263101
|
Local ready
Direct docking supported
|