| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L059021
BDB059021
|
BDBM50520229
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(-c2ccccc2OC)s1
|
C29H31FN6O3S 562.671000 |
XMZAOMNLYKBGRA-HDICACEKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520229; PubChem:CID155537417
|
Local ready
Direct docking supported
|
|
E3L059022
BDB059022
|
BDBM50520230
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(-c2ccccc2C)s1
|
C29H31FN6O2S 546.672000 |
NGMZWDSRIMNTJY-KDURUIRLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520230; PubChem:CID155550965
|
Local ready
Direct docking supported
|
|
E3L059023
BDB059023
|
BDBM50520231
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(-c2ccoc2)s1
|
C26H27FN6O3S 522.606000 |
QAGQPRAGTMJWLG-IYBDPMFKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520231; PubChem:CID155525999
|
Local ready
Direct docking supported
|
|
E3L059024
BDB059024
|
BDBM50520232
COc1ccc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)cc1Cl
|
C17H21ClFN5O 365.840000 |
BPWKTWGLXFWEGW-PHIMTYICSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520232; PubChem:CID155518808
|
Local ready
Direct docking supported
|
|
E3L059025
BDB059025
|
BDBM50520233
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(Br)o1
|
C22H24BrFN6O3 519.375000 |
UGYTUECXXPWXJB-BETUJISGSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520233; PubChem:CID155550865
|
Local ready
Direct docking supported
|
|
E3L059026
BDB059026
|
Bcl6-IN-6
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(C2=CCCC2)s1
|
C27H31FN6O2S 522.650000 |
VJFKSXHAFLCLLP-CALCHBBNSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520234; PubChem:CID155549001
|
Local ready
Direct docking supported
|
|
E3L059027
BDB059027
|
BDBM50520235
COc1ccc(Nc2nc(N(CC(C)C)CC(C)C)ncc2F)cc1Cl
|
C19H26ClFN4O 380.895000 |
DWVCDIMZINSTNN-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520235; PubChem:CID155559510
|
Local ready
Direct docking supported
|
|
E3L059028
BDB059028
|
BDBM50520236
COc1ccc(Nc2nc(N3C[C@H](C)C[C@H](C)C3)ncc2F)cc1Cl
|
C18H22ClFN4O 364.852000 |
FBUAEPXGEQDSDG-TXEJJXNPSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520236; PubChem:CID155561643
|
Local ready
Direct docking supported
|
|
E3L059029
BDB059029
|
BDBM50520237
COc1ccc(Nc2nc(NC3CCCCC3)ncc2F)cc1Cl
|
C17H20ClFN4O 350.825000 |
TWGARLKXIPBSMU-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520237; PubChem:CID155538022
|
Local ready
Direct docking supported
|
|
E3L059030
BDB059030
|
BDBM50520238
COc1ccc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)cc1NC(=O)c1cccc(Br)n1
|
C23H25BrFN7O2 530.402000 |
DZSOMEKOVBRHHK-OKILXGFUSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520238; PubChem:CID155552783
|
Local ready
Direct docking supported
|
|
E3L059031
BDB059031
|
BDBM50520239
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(Br)s1
|
C22H24BrFN6O2S 535.443000 |
GRUSOTNNMOKUDT-BETUJISGSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520239; PubChem:CID155558661
|
Local ready
Direct docking supported
|
|
E3L059032
BDB059032
|
BDBM50520240
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(C2=CCCCC2)s1
|
C28H33FN6O2S 536.677000 |
OHERWAQRPFVCIV-HDICACEKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520240; PubChem:CID155538999
|
Local ready
Direct docking supported
|
|
E3L059033
BDB059033
|
BDBM50520241
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(-c2ccccc2)s1
|
C28H29FN6O2S 532.645000 |
FATUPZVCGKFPAN-HDICACEKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520241; PubChem:CID155528623
|
Local ready
Direct docking supported
|
|
E3L059034
BDB059034
|
BDBM50520242
COc1ccc(Nc2nc(N3CCOCC3)ncc2F)cc1Cl
|
C15H16ClFN4O2 338.770000 |
AVLMMCGZPRSKSO-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520242; PubChem:CID155568277
|
Local ready
Direct docking supported
|
|
E3L059035
BDB059035
|
BDBM50520243
COc1cc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)ccc1NC(=O)c1ccc(-c2ccccc2Cl)s1
|
C28H28ClFN6O2S 567.090000 |
MZTGOVDRMCIBLR-CALCHBBNSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520243; PubChem:CID155525789
|
Local ready
Direct docking supported
|
|
E3L059036
BDB059036
|
BDBM50520244
COc1ccc(Nc2nc(N3C[C@@H](C)N[C@@H](C)C3)ncc2F)cc1NC(=O)c1ccc(Br)s1
|
C22H24BrFN6O2S 535.443000 |
UXYHJAVVDBPOAQ-BETUJISGSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50520244; PubChem:CID155552228
|
Local ready
Direct docking supported
|
|
E3L059037
BDB059037
|
1-(3-Amino-4-ethoxyphenyl)ethanone
CCOc1ccc(C(C)=O)cc1N
|
C10H13NO2 179.219000 |
CBMYGMRLSCLFPD-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50520333; PubChem:CID17245118
|
Local ready
Direct docking supported
|
|
E3L059038
BDB059038
|
BDBM50520584
C=CC(=O)Nc1cc(Nc2ncc(F)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC)cc1N(C)CCN(C)C
|
C28H36FN7O4S 585.706000 |
MLXUDJPUEMLBKJ-UHFFFAOYSA-N | Q9HC35 | ALK tyrosine kinase receptor |
BindingDB, PubChem
BindingDB:BDBM50520584; PubChem:CID155519739
|
Local ready
Direct docking supported
|
|
E3L059039
BDB059039
|
BDBM50520585
C=CC(=O)Nc1cc(Nc2ncc(I)c(Nc3ccccc3P(C)(C)=O)n2)c(OC)cc1N(C)CCN(C)C
|
C27H35IN7O3P 663.501000 |
BPGJJKMCXBBEBI-UHFFFAOYSA-N | Q9HC35 | ALK tyrosine kinase receptor |
BindingDB, PubChem
BindingDB:BDBM50520585; PubChem:CID155561359
|
Local ready
Direct docking supported
|
|
E3L059040
BDB059040
|
BDBM50520586
C=CC(=O)Nc1cc(Nc2ncc(I)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC)cc1N(C)CCN(C)C
|
C28H36IN7O4S 693.612000 |
MFBMGGILJVFTKT-UHFFFAOYSA-N | Q9HC35 | ALK tyrosine kinase receptor |
BindingDB, PubChem
BindingDB:BDBM50520586; PubChem:CID155546345
|
Local ready
Direct docking supported
|