| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L066423
LIG000993
|
24
CC1=CC2ON=C(Nc3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)C2C=C1
|
C21H20N4O4 392.415000 |
NCGUNOWSSSLNKH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB387
|
Local ready
Direct docking supported
|
|
E3L066424
LIG000994
|
7f
O=C1CCC(NC(=O)c2c(F)cccc2[N+](=O)[O-])C(=O)N1
|
C12H10FN3O5 295.226000 |
NCKQLNUOHWBFEB-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB7
|
Local ready
Direct docking supported
|
|
E3L066425
LIG000995
|
SJPYT-216
CC(C)(C)c1cc(N)cc(Oc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)c1
|
C23H23N3O5 421.453000 |
NCRCWXPCGTXGAY-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB83
|
Local ready
Direct docking supported
|
|
E3L066426
LIG000996
|
L16
CCOC(=O)C1CCCN(C(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)n(Cc3ccc(F)cc3)c2=O)C1
|
C27H29FN4O5 508.550000 |
NCWSSJROIXYECM-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB489
|
Local ready
Direct docking supported
|
|
E3L066427
LIG000997
|
1C
O=C1CCC(N2Cc3c(cccc3-c3ccncc3)C2=O)C(=O)N1
|
C18H15N3O3 321.336000 |
NCXOILINUTXILA-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1091
|
Local ready
Direct docking supported
|
|
E3L066428
LIG000998
|
L04
O=C1CCC(N2Cc3cc(NC(=O)COCCOCCOCc4ccccc4)ccc3C2=O)C(=O)N1
|
C26H29N3O7 495.532000 |
NDMFZOULGGHLFN-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1076
|
Local ready
Direct docking supported
|
|
E3L066429
LIG000999
|
32
COc1ccc2cc(OC)c(CNc3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)cc2c1
|
C26H25N3O5 459.502000 |
NDNKSPHAWWCIPN-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB704
|
Local ready
Direct docking supported
|
|
E3L066430
LIG001000
|
LYG-307
O=C1CCC(N2Cc3cc(CNC(=O)C4CCc5ccccc5C4)ccc3C2=O)C(=O)N1
|
C25H25N3O4 431.492000 |
NDSIFXOYXZIPKW-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1341
|
Local ready
Direct docking supported
|
|
E3L066431
LIG001001
|
L3
Cc1ccc(-n2nc(C(=O)NCCN(C)C)c(=O)n(Cc3ccccc3)c2=O)cc1C
|
C23H27N5O3 421.501000 |
NDSVTIUOHHJWSC-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB329
|
Local ready
Direct docking supported
|
|
E3L066432
LIG001002
|
2
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)C2(C#N)CC2)C(C)(C)C)cc1
|
C27H33N5O4S 523.659000 |
NDVQUNZCNAMROD-RZUBCFFCSA-N | P40337, Q15369 | von Hippel-Lindau disease tumor suppressor, Elongin-C |
BindingDB, e3_ligand, MolGlueDB
BindingDB:BDBM50459944; e3_ligand:13; MolGlueDB:MGDB272
|
Local ready
Direct docking supported
|
|
E3L066433
LIG001003
|
(R,S)-3a
CC(C)(C)NC(=O)[C@@]1(C)CCC(=O)N1[C@H]1CCC(=O)NC1=O
|
C15H23N3O4 309.366000 |
NDWWOEYUZWIVQD-BJOHPYRUSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB92
|
Local ready
Direct docking supported
|
|
E3L066434
LIG001004
|
(S,S)-3a
CC(C)(C)NC(=O)[C@]1(C)CCC(=O)N1[C@H]1CCC(=O)NC1=O
|
C15H23N3O4 309.366000 |
NDWWOEYUZWIVQD-VFZGTOFNSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB95
|
Local ready
Direct docking supported
|
|
E3L066435
LIG001005
|
AN5789
COc1ccc2ccccc2c1/C=N/NC(=O)c1cc2cccc(C)c2nc1C
|
C24H21N3O2 383.451000 |
NENJTDWIOYGOPV-AFUMVMLFSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB612
|
Local ready
Direct docking supported
|
|
E3L066436
LIG001006
|
9
Nc1c(Cl)ccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
|
C13H10ClN3O4 307.693000 |
NFAWGTMHOYNYSB-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1286
|
Local ready
Direct docking supported
|
|
E3L066437
LIG001007
|
SJPYT-217
CC(=O)Nc1cc(Oc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)cc(C(C)(C)C)c1
|
C25H25N3O6 463.490000 |
NFBBXPBQJJYUTN-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB69
|
Local ready
Direct docking supported
|
|
E3L066438
LIG001008
|
MG-280
O=C1CCC(N2Cc3c(CCCOCCOCCOCCNC(=O)[C@@H]4NC5(CCCCC5)[C@@]5(C(=O)Nc6cc(Cl)ccc65)[C@H]4c4cccc(Cl)c4F)cccc3C2=O)C(=O)N1
|
C45H50Cl2FN5O8 878.826000 |
NGZJTKCQKBOQNF-XHXLSXGSSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1126
|
Local ready
Direct docking supported
|
|
E3L066439
LIG001009
|
19
O=C1CCC(N2Cc3cc(NCc4ccc5cc(F)ccc5c4)ccc3C2=O)C(=O)N1
|
C24H20FN3O3 417.440000 |
NHERHMLSLSIPJM-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1225
|
Local ready
Direct docking supported
|
|
E3L066440
LIG001010
|
LL-K12-8
CCCCOc1nc(NCc2nc3cc(Cl)c(Cl)cc3[nH]2)c2ncn(CC)c2n1
|
C19H21Cl2N7O 434.331000 |
NHLSBEFLITXPDM-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB454
|
Local ready
Direct docking supported
|
|
E3L066441
LIG001011
|
3
CC(C)(c1ccc(OCC2CCN(C(=O)CCCCCCNc3ccc4c(c3)C(=O)N(C3CCC(=O)NC3=O)C4=O)CC2)cc1)c1ccc(OC[C@H](O)CCl)cc1
|
C44H53ClN4O8 801.381000 |
NHQFDGVRAZZPLX-OVFDOZPJSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1534
|
Local ready
Direct docking supported
|
|
E3L066442
LIG001012
|
dALK-5
Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCN(CCCN2CCN(c3ccc4c(c3)C(=O)N(C3CCC(=O)NC3=O)C4=O)CC2)CC1
|
C48H58ClN9O7S 940.568000 |
NHUGKSKLFFQTOX-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB282
|
Local ready
Direct docking supported
|