| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L028121
BDB028121
|
BDBM576165
Cc1c2cnc3c1nnn3CCCCCCc1c(F)c(F)c(c(F)c1F)C(=O)N1CCc3ccc(cc3C1)[C@@H]2[C@@H](C)C(=O)O
|
C32H31F4N5O3 609.624000 |
KVFJIWUHJVEAAN-HXOBKFHXSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576165
|
Local ready
Direct docking supported
|
|
E3L028122
BDB028122
|
BDBM576166
Cc1c2ccc3c1nnn3CCCCCCc1ccc(cc1CC(F)F)C(=O)N1CCc3ccc(cc3C1)[C@@H]2CC(=O)O
|
C34H36F2N4O3 586.683000 |
BOTBSWSIIBKQPK-LJAQVGFWSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576166
|
Local ready
Direct docking supported
|
|
E3L028123
BDB028123
|
BDBM576167
Cc1c2ccc3c1nnn3CCCCCc1ccc(cc1CC(F)F)C(=O)N1CCc3ccc(cc3C1)[C@@H]2C(C)C(=O)O
|
C34H36F2N4O3 586.683000 |
NKDJDMJKXOYDIW-LAUUFCHVSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576167
|
Local ready
Direct docking supported
|
|
E3L028124
BDB028124
|
BDBM576168
Cc1c2ccc3c1nnn3CCCCCCc1ccc3c(c1)cc(n3CC(F)F)C(=O)N1CCc3ccc(cc3C1)[C@@H]2CC(=O)O
|
C36H37F2N5O3 625.720000 |
IZDCGXJKFOWZHH-LJAQVGFWSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576168
|
Local ready
Direct docking supported
|
|
E3L028125
BDB028125
|
BDBM576169
O=C(O)C[C@@H]1c2cnc(nc2)OC/C=C/CCc2c(F)c(F)c(c(F)c2F)C(=O)N2CCc3ccc1cc3C2
|
C28H23F4N3O4 541.501000 |
LFJUGVIEQRMESZ-OIBGTREISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576169
|
Local ready
Direct docking supported
|
|
E3L028126
BDB028126
|
BDBM576170
Cc1c2ccc3c1nnn3CCCCCc1ccc(cc1CC(F)(F)F)C(=O)N1CCc3ccc(cc3C1)[C@@H]2CC(=O)O
|
C33H33F3N4O3 590.646000 |
PFVRYGHLNCIFSS-NDEPHWFRSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576170
|
Local ready
Direct docking supported
|
|
E3L028127
BDB028127
|
BDBM576171
Cc1c2ccc3c1nnn3CCCCCCc1ccc(cc1CC(F)(F)F)C(=O)N1CCc3ccc(cc3C1)[C@@H]2CC(=O)O
|
C34H35F3N4O3 604.673000 |
ZSHDDGMZWQTLGW-LJAQVGFWSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576171
|
Local ready
Direct docking supported
|
|
E3L028128
BDB028128
|
BDBM576172
Cc1c2n(C)c3ccc(cc13)CC/C=C\CCn1nnc3c(C)c(cnc31)[C@H](CC(=O)O)c1ccc3c(c1)CN(CC3)C2=O
|
C35H36N6O3 588.712000 |
IJDQXSQWJLQCRL-KAPSLNKKSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576172
|
Local ready
Direct docking supported
|
|
E3L028129
BDB028129
|
BDBM576173
Cc1cc2ccc1[C@@H](C(C)C(=O)O)c1ccc3c(c1)CN(CC3)C(=O)c1c(F)c(F)c(c(F)c1F)CCCCCO2
|
C32H31F4NO4 569.595000 |
XSSCSGFATLMXSS-LYIYLXCWSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576173
|
Local ready
Direct docking supported
|
|
E3L028130
BDB028130
|
BDBM576174
O=C(O)C[C@H]1c2cnc(nc2)OCCCCCc2c(F)c(F)c(c(F)c2F)C(=O)N2CCc3ccc1cc3C2
|
C28H25F4N3O4 543.517000 |
MCRMQXORHMGLQE-HXUWFJFHSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576174
|
Local ready
Direct docking supported
|
|
E3L028131
BDB028131
|
BDBM576175
C[C@@H](C(=O)O)[C@@H]1c2ccc(nc2)OCC/C=C/Cc2ccc(cc2)C(=O)N2CCc3ccc1cc3C2
|
C30H30N2O4 482.580000 |
GJLAVSDHBUDAFE-IDLWRVDWSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM576175; PubChem:CID166177970
|
Local ready
Direct docking supported
|
|
E3L028132
BDB028132
|
BDBM576176
C[C@H](C(=O)O)[C@@H]1c2ccc(nc2)OCC/C=C/Cc2ccc(cc2)C(=O)N2CCc3ccc1cc3C2
|
C30H30N2O4 482.580000 |
GJLAVSDHBUDAFE-BMAGSDMKSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM576176; PubChem:CID166177971
|
Local ready
Direct docking supported
|
|
E3L028133
BDB028133
|
BDBM576177
Cc1c2ccc3c1nnn3CCCCCCc1ccc(c3ccccc13)C(=O)N1CCc3ccc(cc3C1)[C@@H]2CC(=O)O
|
C36H36N4O3 572.709000 |
UQQGUFIGHZMUGD-YTTGMZPUSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576177
|
Local ready
Direct docking supported
|
|
E3L028134
BDB028134
|
BDBM576178
Cc1c2ccc3c1nnn3CCCCCc1cccc3c1CC(C(=O)N1CCc4ccc(cc4C1)C2CC(=O)O)N3C
|
C34H37N5O3 563.702000 |
BLSCTBINNGXDFR-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576178
|
Local ready
Direct docking supported
|
|
E3L028135
BDB028135
|
BDBM576179
Cc1c2ccc3c1nnn3CCCCCCc1ccc(c3ccccc13)C(=O)N1CCc3ccc(cc3C1)[C@H]2CC(=O)O
|
C36H36N4O3 572.709000 |
UQQGUFIGHZMUGD-JGCGQSQUSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM576179
|
Local ready
Direct docking supported
|
|
E3L028136
BDB028136
|
4-(aminomethyl)-7-pyridin-2-yl-2H-phthalazin-1-one
NCc1n[nH]c(=O)c2cc(-c3ccccn3)ccc12
|
C14H12N4O 252.277000 |
NGITUWWJVSLWGV-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM578778; PubChem:CID156151530
|
Local ready
Direct docking supported
|
|
E3L028137
BDB028137
|
BDBM578779
CS(=O)(=O)c1cncc(-c2ccc3c(=O)[nH]nc(CN)c3c2)c1
|
C15H14N4O3S 330.369000 |
CXQOMCFEMQNHLG-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM578779; PubChem:CID156151121
|
Local ready
Direct docking supported
|
|
E3L028138
BDB028138
|
4-(aminomethyl)-6-pyridin-3-yl-2H-phthalazin-1-one
NCc1n[nH]c(=O)c2ccc(-c3cccnc3)cc12
|
C14H12N4O 252.277000 |
PLXPGXIFWDSNSZ-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM578780; PubChem:CID156151249
|
Local ready
Direct docking supported
|
|
E3L028139
BDB028139
|
BDBM578781
CCOc1cncc(-c2ccc3c(=O)[nH]nc(CN)c3c2)c1
|
C16H16N4O2 296.330000 |
GXODNXZDQIMYMO-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM578781; PubChem:CID156151569
|
Local ready
Direct docking supported
|
|
E3L028140
BDB028140
|
BDBM578782
Cn1cc(-c2ccc3c(=O)[nH]nc(CN)c3c2)cn1
|
C13H13N5O 255.281000 |
HUDGQDMMFLDCAM-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM578782; PubChem:CID156159664
|
Local ready
Direct docking supported
|