| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L034101
BDB034101
|
BDBM682661
O=C(c1ccc(O[C@H]2CCNC2)c(C2CCCCC2)c1)N1CCC(Oc2cc(F)cc(N3CCC4(CC3)CNC4)c2)CC1
|
C35H47FN4O3 590.784000 |
YASVMCFEHWYVPC-PMERELPUSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682661; PubChem:CID166087172
|
Local ready
Direct docking supported
|
|
E3L034102
BDB034102
|
BDBM682662
O=C(c1ccc(OC2CCNCC2)c(C2CCCCC2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C33H45FN4O3 564.746000 |
HNQIVJZMKJUQQB-UHFFFAOYSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682662; PubChem:CID166087261
|
Local ready
Direct docking supported
|
|
E3L034103
BDB034103
|
BDBM682663
O=C(c1ccc(O[C@@H]2CCNC2)c(C2CCCCC2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C32H43FN4O3 550.719000 |
KERGUDBBTHPPMM-MUUNZHRXSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682663; PubChem:CID166087191
|
Local ready
Direct docking supported
|
|
E3L034104
BDB034104
|
BDBM682664
O=C(c1ccc(O[C@H]2CCNC2)c(-c2ccccc2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C32H37FN4O3 544.671000 |
NAIUBKPGWAVAOY-NDEPHWFRSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682664; PubChem:CID166087259
|
Local ready
Direct docking supported
|
|
E3L034105
BDB034105
|
BDBM682665
O=C(c1ccc(O[C@H]2CCNC2)c(-c2ccc(C(F)(F)F)cc2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C33H36F4N4O3 612.668000 |
BLPXJGDWAFKNNV-NDEPHWFRSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682665; PubChem:CID166087344
|
Local ready
Direct docking supported
|
|
E3L034106
BDB034106
|
BDBM682666
CC(C)(C)c1ccc(-c2cc(C(=O)N3CCC(Oc4cc(F)cc(N5CCNCC5)c4)CC3)ccc2O[C@H]2CCNC2)cc1
|
C36H45FN4O3 600.779000 |
ROKANYYIAWGDJI-HKBQPEDESA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682666; PubChem:CID166087287
|
Local ready
Direct docking supported
|
|
E3L034107
BDB034107
|
BDBM682667
O=C(c1ccc(O[C@H]2CCNC2)c(-c2ccc3ccsc3c2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C34H37FN4O3S 600.760000 |
VUMQDFKHXXKWQW-LJAQVGFWSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682667; PubChem:CID166087370
|
Local ready
Direct docking supported
|
|
E3L034108
BDB034108
|
BDBM682668
O=C(c1ccc(O[C@H]2CCNC2)c(-c2ccc3ccccc3c2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C36H39FN4O3 594.731000 |
XOYAJLOFRHFKQB-YTTGMZPUSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682668; PubChem:CID166087372
|
Local ready
Direct docking supported
|
|
E3L034109
BDB034109
|
BDBM682669
Cn1cc(-c2cc(C(=O)N3CCC(Oc4cc(F)cc(N5CCNCC5)c4)CC3)ccc2O[C@H]2CCNC2)cn1
|
C30H37FN6O3 548.663000 |
OUUPJPMXAADCLT-SANMLTNESA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682669; PubChem:CID166087170
|
Local ready
Direct docking supported
|
|
E3L034110
BDB034110
|
BDBM682670
O=C(c1ccc(O[C@H]2CCNC2)c(-c2ccc3[nH]ncc3c2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C33H37FN6O3 584.696000 |
HACYBVJDWFZNMF-NDEPHWFRSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682670; PubChem:CID166087325
|
Local ready
Direct docking supported
|
|
E3L034111
BDB034111
|
BDBM682671
O=C(c1ccc(O[C@H]2CCNC2)c(-c2ccc3cn[nH]c3c2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C33H37FN6O3 584.696000 |
BGAHOBQJUFMFPH-NDEPHWFRSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682671; PubChem:CID166087413
|
Local ready
Direct docking supported
|
|
E3L034112
BDB034112
|
BDBM682672
O=C(c1ccc(O[C@H]2CCNC2)c(-c2ccc3nc[nH]c3c2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C33H37FN6O3 584.696000 |
WOFPWVHXAVXHJG-MHZLTWQESA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682672; PubChem:CID166087318
|
Local ready
Direct docking supported
|
|
E3L034113
BDB034113
|
BDBM682673
O=C(c1ccc(O[C@H]2CCNC2)c(-c2cn[nH]c2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C29H35FN6O3 534.636000 |
QDEHPOWLDQYBJC-VWLOTQADSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682673; PubChem:CID166087184
|
Local ready
Direct docking supported
|
|
E3L034114
BDB034114
|
BDBM682674
O=C(c1ccc(O[C@H]2CCNC2)c(C2CCC(C(F)(F)F)CC2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C33H42F4N4O3 618.716000 |
XHNAKAIMMQAAQF-WWGLSMKPSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682674; PubChem:CID166087338
|
Local ready
Direct docking supported
|
|
E3L034115
BDB034115
|
BDBM682675
CC(C)(C)C1CCC(c2cc(C(=O)N3CCC(Oc4cc(F)cc(N5CCNCC5)c4)CC3)ccc2O[C@H]2CCNC2)CC1
|
C36H51FN4O3 606.827000 |
BWCHFLVXYSMPCQ-IWDREJCQSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682675; PubChem:CID166087248
|
Local ready
Direct docking supported
|
|
E3L034116
BDB034116
|
BDBM682676
O=C(c1ccc(O[C@H]2CCNC2)c(C2CCOCC2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C31H41FN4O4 552.691000 |
HHPPRVOYKFWVMP-MHZLTWQESA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682676; PubChem:CID166087157
|
Local ready
Direct docking supported
|
|
E3L034117
BDB034117
|
BDBM682677
O=C(c1ccc(O[C@H]2CCNC2)c(C2CCN(C(=O)C3CC3)CC2)c1)N1CCC(Oc2cc(F)cc(N3CCNCC3)c2)CC1
|
C35H46FN5O4 619.782000 |
IJYSMRIQFUMJLP-PMERELPUSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682677; PubChem:CID166087446
|
Local ready
Direct docking supported
|
|
E3L034118
BDB034118
|
BDBM682678
CC(C)C(=O)N1CCC(c2cc(C(=O)N3CCC(Oc4cc(F)cc(N5CCNCC5)c4)CC3)ccc2O[C@H]2CCNC2)CC1
|
C35H48FN5O4 621.798000 |
OWUYCYZHXAMZOW-PMERELPUSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682678; PubChem:CID166087234
|
Local ready
Direct docking supported
|
|
E3L034119
BDB034119
|
BDBM682679
CC(O)C(=O)N1CCC(c2cc(C(=O)N3CCC(Oc4cc(F)cc(N5CCNCC5)c4)CC3)ccc2O[C@H]2CCNC2)CC1
|
C34H46FN5O5 623.770000 |
DGJBVLGGSOBXJL-IZCXSWDTSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682679; PubChem:CID166087273
|
Local ready
Direct docking supported
|
|
E3L034120
BDB034120
|
BDBM682680
CC(C)(C)C(=O)N1CCC(c2cc(C(=O)N3CCC(Oc4cc(F)cc(N5CCNCC5)c4)CC3)ccc2O[C@H]2CCNC2)CC1
|
C36H50FN5O4 635.825000 |
ODEDFWVPEIZNQQ-PMERELPUSA-N | P12830 | Catenin beta-1 |
BindingDB, PubChem
BindingDB:BDBM682680; PubChem:CID166087427
|
Local ready
Direct docking supported
|