| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L064241
BDB064241
|
BDBM50630271
O=C(c1cc(Cn2c(=O)[nH]c(=O)c3ccccc32)ccc1F)N1CC(=O)N2CCCC2C1
|
C23H21FN4O4 436.443000 |
UWPDADPDWVTOEC-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50630271; PubChem:CID172466701
|
Local ready
Direct docking supported
|
|
E3L064242
BDB064242
|
BDBM50630272
O=C(c1cc(Cn2c(=O)[nH]c(=O)c3ccccc32)ccc1F)N1CC(=O)N2CCCCC2C1
|
C24H23FN4O4 450.470000 |
XVWZUMYLDUPVRN-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50630272; PubChem:CID172450260
|
Local ready
Direct docking supported
|
|
E3L064243
BDB064243
|
PARP7-IN-16 free base
CCC(CC)N1CCN(C(=O)c2cc(Cn3c(=O)[nH]c(=O)c4ccccc43)ccc2F)CC1=O
|
C25H27FN4O4 466.513000 |
WKXCQZQWHUTWSY-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50630273; PubChem:CID146659481
|
Local ready
Direct docking supported
|
|
E3L064244
BDB064244
|
BDBM50630610
CC(=O)Nc1sccc1C(=O)NC1CCC(=O)NC1=O
|
C12H13N3O4S 295.320000 |
OXPSJLDBCVUULG-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, PubChem
BindingDB:BDBM50630610; PubChem:CID156408625
|
Local ready
Direct docking supported
|
|
E3L064245
BDB064245
|
BDBM50630611
Cc1cc2cccc(C(=O)NC3CCC(=O)NC3=O)c2o1
|
C15H14N2O4 286.287000 |
LVMVFZVVJVFJKX-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, PubChem
BindingDB:BDBM50630611; PubChem:CID156408646
|
Local ready
Direct docking supported
|
|
E3L064246
BDB064246
|
BDBM50630755
C[C@@]12COCCN1c1nc(-c3cccc4[nH]ccc34)ncc1N([C@H]1CC[C@H](O)CC1)C2=O
|
C24H27N5O3 433.512000 |
OYXPDKVBMCFEJF-YWTKSJFSSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB
BindingDB:BDBM50630755
|
Local ready
Direct docking supported
|
|
E3L064247
BDB064247
|
BDBM50630782
Nc1ccn(S(=O)(=O)c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3)c(=O)n1
|
C17H15N5O6S 417.403000 |
MBJWTDRCYZYMDO-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, PubChem
BindingDB:BDBM50630782; PubChem:CID172459362
|
Local ready
Direct docking supported
|
|
E3L064248
BDB064248
|
BDBM50631168
O=C(NC1(c2ccc(Cl)cc2)COC1)c1ccc(N2CCC(O)CC2)cc1
|
C21H23ClN2O3 386.879000 |
JWHDAMWJTVZNSF-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631168; PubChem:CID166304561
|
Local ready
Direct docking supported
|
|
E3L064249
BDB064249
|
Wdr91-IN-1
O=C(NC1(c2ccc(Cl)cc2)COC1)c1ccc(N2CCC(O)C2)cc1
|
C20H21ClN2O3 372.852000 |
XRPYHXDCSXOQDK-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631169; PubChem:CID169494476
|
Local ready
Direct docking supported
|
|
E3L064250
BDB064250
|
BDBM50631170
CN1CCc2cc(C(=O)NC3(c4ccc(Cl)cc4)COC3)sc2C1
|
C18H19ClN2O2S 362.882000 |
UBOWMXHLJCIWRM-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631170; PubChem:CID166401797
|
Local ready
Direct docking supported
|
|
E3L064251
BDB064251
|
BDBM50631171
O=C(NC1(c2ccc(Cl)cc2)COC1)c1ccc(-c2cc[nH]n2)s1
|
C17H14ClN3O2S 359.838000 |
SEUCOARRLOTMHQ-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631171; PubChem:CID166401806
|
Local ready
Direct docking supported
|
|
E3L064252
BDB064252
|
BDBM50631172
Cc1cn2cc(C(=O)NC3(c4ccc(Cl)cc4)COC3)sc2n1
|
C16H14ClN3O2S 347.827000 |
JPIZQLVKWLKGRP-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631172; PubChem:CID166401792
|
Local ready
Direct docking supported
|
|
E3L064253
BDB064253
|
BDBM50631173
O=C(NC1(c2ccc(Cl)cc2)COC1)c1ccc(CN2CCCC2=O)cc1
|
C21H21ClN2O3 384.863000 |
WPCWZULPRNURBM-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631173; PubChem:CID166304560
|
Local ready
Direct docking supported
|
|
E3L064254
BDB064254
|
BDBM50631174
O=C(NC1(c2ccc(Cl)cc2)COC1)c1ccc2snnc2c1
|
C16H12ClN3O2S 345.811000 |
XEJAJMAAPOGDHE-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631174; PubChem:CID166401787
|
Local ready
Direct docking supported
|
|
E3L064255
BDB064255
|
BDBM50631175
O=C(NC(CCO)c1ccc(Cl)cc1)c1ccc(N2CCC(O)C2)cc1
|
C20H23ClN2O3 374.868000 |
KTDLRWJOPUTWPZ-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631175; PubChem:CID166309726
|
Local ready
Direct docking supported
|
|
E3L064256
BDB064256
|
BDBM50631176
O=C(NC1(c2ccc(Cl)cc2)COC1)c1ccc(C2(O)COC2)cc1
|
C19H18ClNO4 359.809000 |
DHLLDGMCPFUWLT-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631176; PubChem:CID166304562
|
Local ready
Direct docking supported
|
|
E3L064257
BDB064257
|
BDBM50631177
NC(=O)C1CCCN(c2ccc(C(=O)NC(c3ccc(Cl)cc3)C3CC3)cc2)C1
|
C23H26ClN3O2 411.933000 |
KJASXXTWLACUNS-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631177; PubChem:CID166182566
|
Local ready
Direct docking supported
|
|
E3L064258
BDB064258
|
BDBM50631178
CC(=O)NCc1ccc(C(=O)NC2(c3ccc(Cl)cc3)COC2)cc1
|
C19H19ClN2O3 358.825000 |
XQNSNYPBYOWPSM-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631178; PubChem:CID166303639
|
Local ready
Direct docking supported
|
|
E3L064259
BDB064259
|
BDBM50631179
NC(=O)C1CCCN(c2ccc(C(=O)NC(CCO)c3ccc(Cl)cc3)cc2)C1
|
C22H26ClN3O3 415.921000 |
JSDBWYJUXBUVJL-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631179; PubChem:CID166207984
|
Local ready
Direct docking supported
|
|
E3L064260
BDB064260
|
BDBM50631180
Nc1ncnc2ccc(C(=O)NC3(c4ccc(Cl)cc4)COC3)cc12
|
C18H15ClN4O2 354.797000 |
ASXJPKLCDSLKGQ-UHFFFAOYSA-N | A4D1P6 | WD repeat-containing protein 91 |
BindingDB, PubChem
BindingDB:BDBM50631180; PubChem:CID172469714
|
Local ready
Direct docking supported
|