| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L008201
BDB008201
|
Me2NCO-Ala-Arg-Ala-NH2
C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)N(C)C)C(N)=O
|
C15H30N8O4 386.457000 |
JTVZAMBODGMZJW-GUBZILKMSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200710; PubChem:CID54766309
|
Local ready
Direct docking supported
|
|
E3L008202
BDB008202
|
MeNHCO-Ala-Arg-Ala-NH2
CNC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(N)=O
|
C14H28N8O4 372.430000 |
WFQKMXWEVDYJHB-CIUDSAMLSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200711; PubChem:CID54766311
|
Local ready
Direct docking supported
|
|
E3L008203
BDB008203
|
BDBM200712
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccccc2)c2ccccc2)CCCC1
|
C35H51N7O4 633.838000 |
BCIPILGGOSCOMC-MHZLTWQESA-N | P61964, Q03164 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM200712; PubChem:CID53356803
|
Local ready
Direct docking supported
|
|
E3L008204
BDB008204
|
isobutyryl-Ac4c-Arg-Ac5c-NHbenzhydryl
CC(C)C(=O)NC1(C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC2(C(=O)NC(c3ccccc3)c3ccccc3)CCCC2)CCC1
|
C34H47N7O4 617.795000 |
AHQYIQDWQARLQG-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200713; PubChem:CID54766310
|
Local ready
Direct docking supported
|
|
E3L008205
BDB008205
|
BDBM200714
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC1(C(N)=O)CCCC1
|
C22H41N7O4 467.615000 |
QVJKZGZNHZHARO-HNNXBMFYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200714; PubChem:CID54766312
|
Local ready
Direct docking supported
|
|
E3L008206
BDB008206
|
BDBM200715
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@H](CCCNC(=N)N)C(=O)NC1(C(N)=O)CCCC1
|
C22H41N7O4 467.615000 |
QVJKZGZNHZHARO-OAHLLOKOSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200715; PubChem:CID54766453
|
Local ready
Direct docking supported
|
|
E3L008207
BDB008207
|
BDBM200716
CCC(CC)(NC(=O)c1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC1(C(N)=O)CCCC1
|
C25H39N7O4 501.632000 |
VXZSITZXVUHSHP-SFHVURJKSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200716; PubChem:CID54766454
|
Local ready
Direct docking supported
|
|
E3L008208
BDB008208
|
BDBM200717
CCC(CC)(NC(=O)c1ccccc1)C(=O)N[C@H](CCCNC(=N)N)C(=O)NC1(C(N)=O)CCCC1
|
C25H39N7O4 501.632000 |
VXZSITZXVUHSHP-GOSISDBHSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200717; PubChem:CID54766455
|
Local ready
Direct docking supported
|
|
E3L008209
BDB008209
|
BDBM200718
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N(C)C)C(=O)NC1(C(N)=O)CCCC1
|
C24H45N7O4 495.669000 |
HSVMNYHLCGEICV-KRWDZBQOSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200718; PubChem:CID54766456
|
Local ready
Direct docking supported
|
|
E3L008210
BDB008210
|
BDBM200719
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccccc2)c2ccccc2)CCCC1
|
C35H51N7O4 633.838000 |
BCIPILGGOSCOMC-HHHXNRCGSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200719; PubChem:CID54766610
|
Local ready
Direct docking supported
|
|
E3L008211
BDB008211
|
BDBM200720
CCC(CC)(NC(=O)c1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccccc2)c2ccccc2)CCCC1
|
C38H49N7O4 667.855000 |
YWGKGTVABIBGNO-PMERELPUSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200720; PubChem:CID54766457
|
Local ready
Direct docking supported
|
|
E3L008212
BDB008212
|
BDBM200721
CCC(CC)(NC(=O)c1ccccc1)C(=O)N[C@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccccc2)c2ccccc2)CCCC1
|
C38H49N7O4 667.855000 |
YWGKGTVABIBGNO-SSEXGKCCSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200721; PubChem:CID54766611
|
Local ready
Direct docking supported
|
|
E3L008213
BDB008213
|
BDBM200722
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CCCC1
|
C35H49Cl2N7O4 702.728000 |
PTJOIPPVAWDZSV-MHZLTWQESA-N | P61964, Q03164 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB
BindingDB:BDBM200722
|
Local ready
Direct docking supported
|
|
E3L008214
BDB008214
|
HMTase Inhibitor IX
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccc(F)cc2)c2ccc(F)cc2)CCCC1
|
C35H49F2N7O4 669.818000 |
RZKSQRIPRKWVBU-MHZLTWQESA-N | P61964, Q03164, Q15291 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM200723; PubChem:CID54766613
|
Local ready
Direct docking supported
|
|
E3L008215
BDB008215
|
BDBM200724
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CCCC1
|
C35H49Cl2N7O4 702.728000 |
PTJOIPPVAWDZSV-HHHXNRCGSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB
BindingDB:BDBM200724
|
Local ready
Direct docking supported
|
|
E3L008216
BDB008216
|
BDBM200725
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@H](CCCNC(=N)N)C(=O)NC1(C(=O)NC(c2ccc(F)cc2)c2ccc(F)cc2)CCCC1
|
C35H49F2N7O4 669.818000 |
RZKSQRIPRKWVBU-HHHXNRCGSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB
BindingDB:BDBM200725
|
Local ready
Direct docking supported
|
|
E3L008217
BDB008217
|
BDBM200726
CC[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CC)(CC)NC(=O)C(C)C
|
C20H40N6O3 412.579000 |
UZDRPSQMJNPDJV-GJZGRUSLSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200726; PubChem:CID54766917
|
Local ready
Direct docking supported
|
|
E3L008218
BDB008218
|
BDBM200727
CCC(CC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CC)(CC)NC(=O)C(C)C
|
C21H42N6O3 426.606000 |
ZYWHWXWISRCLFE-INIZCTEOSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200727; PubChem:CID54766764
|
Local ready
Direct docking supported
|
|
E3L008219
BDB008219
|
BDBM200728
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)Nc1ccccc1
|
C22H36N6O3 432.569000 |
YLSBFCSLZVABMI-KRWDZBQOSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200728; PubChem:CID54766763
|
Local ready
Direct docking supported
|
|
E3L008220
BDB008220
|
BDBM200729
CCC(CC)(NC(=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCc1ccccc1
|
C23H38N6O3 446.596000 |
UAVQXVFBONTBCB-SFHVURJKSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM200729; PubChem:CID54766765
|
Local ready
Direct docking supported
|