| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L059981
BDB059981
|
BDBM50541573
[C][C][C][C][C]C1=[C]C(=O)C2=C(OC([C])([C][C][C]=C([C])[C])[C]=[C]2)C1=O
|
C21O3 300.228000 |
SFFLUFZOKRCIIU-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB
BindingDB:BDBM50541573
|
Local ready
Direct docking supported
|
|
E3L059982
BDB059982
|
BDBM50541574
[C][C][C][C][C]C1=[C]C(=O)C([C]/[C]=C(\[C])[C][C][C]=C([C])[C])=C([O])C1=O
|
C21O3 300.228000 |
ITWBWXMIILEZCP-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB
BindingDB:BDBM50541574
|
Local ready
Direct docking supported
|
|
E3L059983
BDB059983
|
FXIa-IN-6
COC(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)CCC[C@H](N1CCC(c3c(F)ccc(Cl)c3F)=CC1=O)c1cc-2ccn1
|
C31H29ClF2N4O4 595.046000 |
AXXYATYQRMPQSN-QUGAMOGWSA-N | P00748 | Coagulation factor XII |
BindingDB, PubChem
BindingDB:BDBM50541586; PubChem:CID72792438
|
Local ready
Direct docking supported
|
|
E3L059984
BDB059984
|
BDBM50541697
CCOc1ccc(-c2nnc([C@H]3C[C@H](NC(=O)c4ccccn4)C3)n2-c2ccccc2F)nc1
|
C25H23FN6O2 458.497000 |
ZBRBBDJXHBEGHX-QAQDUYKDSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB
BindingDB:BDBM50541697
|
Local ready
Direct docking supported
|
|
E3L059985
BDB059985
|
BDBM50541820
Nc1ccc(C(=O)NC2CCC(=O)NC2=O)c2ncccc12
|
C15H14N4O3 298.302000 |
PGZSDBAKIPEVMI-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, PubChem
BindingDB:BDBM50541820; PubChem:CID153384914
|
Local ready
Direct docking supported
|
|
E3L059986
BDB059986
|
BDBM50541821
Nc1ccnc2c(C(=O)NC3CCC(=O)NC3=O)cccc12
|
C15H14N4O3 298.302000 |
UGROCUUBWRTGOP-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, PubChem
BindingDB:BDBM50541821; PubChem:CID152000954
|
Local ready
Direct docking supported
|
|
E3L059987
BDB059987
|
BDBM50541993
O=C1Cc2cc(Nc3nc(NCc4cccc(S(=O)(=O)F)c4)ncc3Cl)ccc2N1
|
C19H15ClFN5O3S 447.879000 |
PWZVWZMMSGDROT-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50541993; PubChem:CID156015453
|
Local ready
Direct docking supported
|
|
E3L059988
BDB059988
|
BDBM50541994
CNC(=O)COc1cc2cc(Nc3nc(NCc4cccc(S(=O)(=O)F)c4)ncc3Cl)cc(OC)c2n(C)c1=O
|
C25H24ClFN6O6S 591.021000 |
VNVCMPVIJOIVJD-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM50541994
|
Local ready
Direct docking supported
|
|
E3L059989
BDB059989
|
BDBM50541995
CNC(=O)COc1cc2cc(Nc3nc(NCc4cccc(S(C)(=O)=O)c4)ncc3Cl)cc(OC)c2n(C)c1=O
|
C26H27ClN6O6S 587.058000 |
AWMHWEJXBVPJOM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50541995; PubChem:CID156018027
|
Local ready
Direct docking supported
|
|
E3L059990
BDB059990
|
BDBM50542044
NS(=O)(=O)c1ccc(CCNC(C(=O)c2c[nH]c3ccccc23)c2ccccc2)cc1
|
C24H23N3O3S 433.533000 |
GLJNFDHGTNKTJR-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542044; PubChem:CID16332624
|
Local ready
Direct docking supported
|
|
E3L059991
BDB059991
|
BDBM50542045
O=C(c1c[nH]c2ccccc12)C(NCCc1ccccc1)c1ccccc1
|
C24H22N2O 354.453000 |
ACAMGSSSBUKFLV-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542045; PubChem:CID139422897
|
Local ready
Direct docking supported
|
|
E3L059992
BDB059992
|
BDBM50542046
Cn1cc(-c2ccc3c(C(=O)[C@H](NCCc4ccc(C#N)cc4)c4ccccc4)c[nH]c3c2)cn1
|
C29H25N5O 459.553000 |
ZEMJUJNMCGYHGO-MUUNZHRXSA-N | Q09472, Q92793 | Histone acetyltransferase p300, CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50542046; PubChem:CID156011000
|
Local ready
Direct docking supported
|
|
E3L059993
BDB059993
|
BDBM50542047
Cn1cc(-c2ccc3c(C(=O)[C@H](NCCc4ccc(C#N)cc4)c4ccccc4)c[nH]c3n2)cn1
|
C28H24N6O 460.541000 |
HGYKTRJMLUZZLV-AREMUKBSSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542047; PubChem:CID156015358
|
Local ready
Direct docking supported
|
|
E3L059994
BDB059994
|
BDBM50542048
Cn1cc(-c2ccc3c(C(=O)C(NCCc4ccc(C#N)cc4)c4ccccc4)n[nH]c3c2)cn1
|
C28H24N6O 460.541000 |
ORJSKSPGDZAPOU-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542048; PubChem:CID139422785
|
Local ready
Direct docking supported
|
|
E3L059995
BDB059995
|
BDBM50542049
Cn1cc(-c2ccn3c(C(=O)[C@H](NCCc4ccc(C#N)cc4)c4ccccc4)cnc3c2)cn1
|
C28H24N6O 460.541000 |
RYPHRIMKBWOBND-HHHXNRCGSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542049; PubChem:CID156015160
|
Local ready
Direct docking supported
|
|
E3L059996
BDB059996
|
BDBM50542050
Cc1nc(C(=O)[C@H](NCCc2ccc(C#N)cc2)c2ccccc2)c2ccc(-c3cnn(C)c3)cn12
|
C29H26N6O 474.568000 |
BJUXGZGSKAEGKM-HHHXNRCGSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542050; PubChem:CID156011439
|
Local ready
Direct docking supported
|
|
E3L059997
BDB059997
|
BDBM50542051
Cn1cc(-c2ccc3c(C(=O)[C@H](NCCc4ccc(C#N)cc4)c4ccccc4)cnn3c2)cn1
|
C28H24N6O 460.541000 |
DYJWRRZUNKSBCH-HHHXNRCGSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542051; PubChem:CID156020187
|
Local ready
Direct docking supported
|
|
E3L059998
BDB059998
|
BDBM50542052
Cn1cc(-c2ccc3c(c2)CCN3C(=O)[C@H](NCCc2ccc(C#N)cc2)c2ccccc2)cn1
|
C29H27N5O 461.569000 |
PLIOUZZJBKYIKV-MUUNZHRXSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542052; PubChem:CID156017474
|
Local ready
Direct docking supported
|
|
E3L059999
BDB059999
|
BDBM50542053
Cn1cc(-c2ccc3c(c2)CCCN3C(=O)[C@H](NCCc2ccc(C#N)cc2)c2ccccc2)cn1
|
C30H29N5O 475.596000 |
UDCVHWNHBVZORU-GDLZYMKVSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542053; PubChem:CID156010564
|
Local ready
Direct docking supported
|
|
E3L060000
BDB060000
|
BDBM50542054
Cn1cc(-c2ccc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3ccccc3)cc2)cn1
|
C27H25N5O 435.531000 |
PPUQKDMNCLOBAH-AREMUKBSSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50542054; PubChem:CID156014665
|
Local ready
Direct docking supported
|