| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L062841
BDB062841
|
BDBM50606754
Cc1cc(C)c(C(=O)N2CCN(c3ncccc3F)[C@H](CO)C2)cc1NC1CCN(c2ccccc2C#N)CC1
|
C31H35FN6O2 542.659000 |
IEEJBCKDNGRROT-VWLOTQADSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM50606754; PubChem:CID134493175
|
Local ready
Direct docking supported
|
|
E3L062842
BDB062842
|
BDBM50606755
Cc1cc(C)c(C(=O)N2CCN(c3ccccc3)C(C(N)=O)C2)c(C)c1NC1CCN(c2ccc(F)cc2C#N)CC1
|
C33H37FN6O2 568.697000 |
IXGXFXPKQGUFLV-UHFFFAOYSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM50606755; PubChem:CID139473846
|
Local ready
Direct docking supported
|
|
E3L062843
BDB062843
|
BDBM50606756
Cc1cc(C)c(C(=O)N2CCN(c3ccc(F)cn3)[C@H](CO)C2)c(C)c1NC1CCN(c2cccnn2)CC1
|
C29H36FN7O2 533.652000 |
YTQAUCZNPTYTRY-DEOSSOPVSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM50606756; PubChem:CID139491856
|
Local ready
Direct docking supported
|
|
E3L062844
BDB062844
|
BDBM50606757
Cc1cc(C)c(C(=O)N2CCN(c3ccccn3)[C@H](CO)C2)cc1NC1CCN(c2ccccc2OC(F)F)CC1
|
C31H37F2N5O3 565.665000 |
CSTRZYJUXMVMTK-DEOSSOPVSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM50606757; PubChem:CID134493191
|
Local ready
Direct docking supported
|
|
E3L062845
BDB062845
|
BDBM50606945
CC(=O)c1nc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n(C2CCCC2)c1=O
|
C24H29N7O2 447.543000 |
CPKLUQZOENPOAC-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM50606945; PubChem:CID168299155
|
Local ready
Direct docking supported
|
|
E3L062846
BDB062846
|
CDK4/6 inhibitor L12
CCN1CCN(c2ccc(Nc3ncc4nc(C(C)=O)c(=O)n(C5CCCC5)c4n3)cc2)CC1
|
C25H31N7O2 461.570000 |
JWXFZMDNUUBYBZ-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM50606946; PubChem:CID167312199
|
Local ready
Direct docking supported
|
|
E3L062847
BDB062847
|
6-Fluoro-2-methylquinolin-4-ol
Cc1cc(O)c2cc(F)ccc2n1
|
C10H8FNO 177.178000 |
BKXCHVFCJZJATJ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607320; PubChem:CID85184
|
Local ready
Direct docking supported
|
|
E3L062848
BDB062848
|
9-Oxo-4-fluorenecarboxamide
NC(=O)c1cccc2c1-c1ccccc1C2=O
|
C14H9NO2 223.231000 |
PRROCNFTWSJBTJ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607321; PubChem:CID297677
|
Local ready
Direct docking supported
|
|
E3L062849
BDB062849
|
p-(2-(Dimethylamino)ethoxy)benzylamine
CN(C)CCOc1ccc(CN)cc1
|
C11H18N2O 194.278000 |
OBHPRQNPNGQGCK-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607322; PubChem:CID88349
|
Local ready
Direct docking supported
|
|
E3L062850
BDB062850
|
4-Ethynyl-5-methylsulfanylthiophene-2-carboxylic acid
C#Cc1cc(C(=O)O)sc1SC
|
C8H6O2S2 198.268000 |
DTXCUCIQNPLERA-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607323; PubChem:CID168298214
|
Local ready
Direct docking supported
|
|
E3L062851
BDB062851
|
alpha-Cyclopentylmandelic acid
O=C(O)C(O)(c1ccccc1)C1CCCC1
|
C13H16O3 220.268000 |
WFLUEQCOAQCQLP-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607324; PubChem:CID98283
|
Local ready
Direct docking supported
|
|
E3L062852
BDB062852
|
2,6-Dichloro-5-fluoronicotinic acid
O=C(O)c1cc(F)c(Cl)nc1Cl
|
C6H2Cl2FNO2 209.991000 |
LTDGKGCHRNNCAC-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607325; PubChem:CID2733659
|
Local ready
Direct docking supported
|
|
E3L062853
BDB062853
|
BDBM50607326
O=C(NC(Cc1ccccc1)C(=O)O)c1cccc2c1-c1ccccc1C2=O
|
C23H17NO4 371.392000 |
CIAIDQZONHTBIP-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607326; PubChem:CID4908821
|
Local ready
Direct docking supported
|
|
E3L062854
BDB062854
|
2-(N-(9-oxofluorene-4-carbonyl)anilino)acetic acid
O=C(O)CN(C(=O)c1cccc2c1-c1ccccc1C2=O)c1ccccc1
|
C22H15NO4 357.365000 |
FQHYTDQAVPPOKV-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607327; PubChem:CID168299706
|
Local ready
Direct docking supported
|
|
E3L062855
BDB062855
|
2-[Benzyl-(9-oxofluorene-4-carbonyl)amino]acetic acid
O=C(O)CN(Cc1ccccc1)C(=O)c1cccc2c1-c1ccccc1C2=O
|
C23H17NO4 371.392000 |
YZZFNYALOUAXAQ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607328; PubChem:CID168297981
|
Local ready
Direct docking supported
|
|
E3L062856
BDB062856
|
BDBM50607329
O=C(NCC(C(=O)O)c1ccccc1)c1cccc2c1-c1ccccc1C2=O
|
C23H17NO4 371.392000 |
WNKUSGBEYIIXAX-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607329; PubChem:CID168299108
|
Local ready
Direct docking supported
|
|
E3L062857
BDB062857
|
BDBM50607330
O=C(NCC(Cc1ccccc1)C(=O)O)c1cccc2c1-c1ccccc1C2=O
|
C24H19NO4 385.419000 |
TXWCHQXQJNFHSN-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607330; PubChem:CID168298880
|
Local ready
Direct docking supported
|
|
E3L062858
BDB062858
|
BDBM50607331
O=C(O)CC(NC(=O)c1cccc2c1-c1ccccc1C2=O)c1ccccc1
|
C23H17NO4 371.392000 |
NSNGZFFVTUUZBO-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607331; PubChem:CID168298502
|
Local ready
Direct docking supported
|
|
E3L062859
BDB062859
|
BDBM50607332
O=C(O)CC(Cc1ccccc1)NC(=O)c1cccc2c1-c1ccccc1C2=O
|
C24H19NO4 385.419000 |
LRQISGYHMRRWQF-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607332; PubChem:CID168299490
|
Local ready
Direct docking supported
|
|
E3L062860
BDB062860
|
3-(N-(9-oxofluorene-4-carbonyl)anilino)propanoic acid
O=C(O)CCN(C(=O)c1cccc2c1-c1ccccc1C2=O)c1ccccc1
|
C23H17NO4 371.392000 |
RNMQPFDNAXMOFS-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50607333; PubChem:CID168299611
|
Local ready
Direct docking supported
|