| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013541
BDB013541
|
US10144731, Example 182
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2C)cc1CN1CC2CCCCC2CS1(=O)=O
|
C27H34N4O4S 510.660000 |
RXICIKJEPOJGIF-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304874; PubChem:CID118170723
|
Local ready
Direct docking supported
|
|
E3L013542
BDB013542
|
US10144731, Example 183
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2C)cc1CN1Cc2ccccc2CS1(=O)=O
|
C27H28N4O4S 504.612000 |
QRYZXQWLCHRQQQ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304875; PubChem:CID118170119
|
Local ready
Direct docking supported
|
|
E3L013543
BDB013543
|
US10144731, Example 184
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2C)cc1CN1CC2CCCCC2CCS1(=O)=O
|
C28H36N4O4S 524.687000 |
GFQRQKUOFVNFKW-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304876; PubChem:CID118170296
|
Local ready
Direct docking supported
|
|
E3L013544
BDB013544
|
US10144731, Example 185
Cc1ccc(CCC(CC(=O)O)c2ccc(C)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)cc1
|
C29H33NO5S 507.652000 |
BAPMTSPSGNUDMN-UFUCKMQHSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304877; PubChem:CID118170019
|
Local ready
Direct docking supported
|
|
E3L013545
BDB013545
|
US10144731, Example 186
Cc1ccc(C(CC(=O)O)c2ccc(F)cc2F)cc1CN1CC(C)Cc2cc(CCCN(C)C)ccc2S1(=O)=O
|
C32H38F2N2O4S 584.729000 |
WIHQYZMEMCQRKR-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304878; PubChem:CID118170005
|
Local ready
Direct docking supported
|
|
E3L013546
BDB013546
|
US10144731, Example 187
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc4c(c3)CN(C)CC4)ccc2C)S(=O)(=O)c2ccccc2O1
|
C31H36N2O5S 548.705000 |
QLBKVJGMFUFAFO-QXPUDEPPSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304879; PubChem:CID118169992
|
Local ready
Direct docking supported
|
|
E3L013547
BDB013547
|
US10144731, Example 188
Cc1ccc(C(CC(=O)O)C2CC2c2cn(C)nn2)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C26H30N4O5S 510.616000 |
TWSWLFZHICHMLD-LAQKFSSHSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304880; PubChem:CID118170278
|
Local ready
Direct docking supported
|
|
E3L013548
BDB013548
|
US10144731, Example 120
Cc1ccc(C(c2ccc3c(nnn3C)c2C)C(C)C(=O)O)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C29H33N5O4S 547.681000 |
GFARMNLPSPHGIR-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304881; PubChem:CID118170111
|
Local ready
Direct docking supported
|
|
E3L013549
BDB013549
|
BDBM304887
CC[C@@H]1CN(Cc2cc(C(CCc3cn(CC)nn3)C(C)C(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C28H36N4O5S 540.686000 |
IDANVQJFZXIQGM-FMGHMSBISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304887; PubChem:CID118170028
|
Local ready
Direct docking supported
|
|
E3L013550
BDB013550
|
BDBM304888
CC[C@@H]1CN(Cc2cc(C(CCc3cn(CC)nn3)C(C)C(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C28H36N4O5S 540.686000 |
IDANVQJFZXIQGM-FMGHMSBISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304888; PubChem:CID118170028
|
Local ready
Direct docking supported
|
|
E3L013551
BDB013551
|
US10144731, Example 194
CC[C@@H]1CN(Cc2cc(C(CCc3cn(CC)nn3)CC(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C27H34N4O5S 526.659000 |
OFFIZNQRXWXRFR-MQNHUJCZSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304889; PubChem:CID118170583
|
Local ready
Direct docking supported
|
|
E3L013552
BDB013552
|
US10144731, Example 195
COCCC(CC(=O)O)c1ccc(C)c(CN2C[C@@H](C)Oc3ccccc3S2(=O)=O)c1
|
C23H29NO6S 447.553000 |
MDMOGTPMLUHGBG-DUSLRRAJSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304890; PubChem:CID118170075
|
Local ready
Direct docking supported
|
|
E3L013553
BDB013553
|
US10144731, Example 196
Cc1ccc(C(CCC2CCCC2)CC(=O)O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C27H35NO5S 485.646000 |
JWCCGAXRMNTCEB-PPUHSXQSSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304891; PubChem:CID118170092
|
Local ready
Direct docking supported
|
|
E3L013554
BDB013554
|
US10144731, Example 197
CC[C@@H]1CN(Cc2cc(C(CCc3cn(CC)nn3)CC(=O)O)ccc2C(F)(F)F)S(=O)(=O)c2cnccc2O1
|
C26H30F3N5O5S 581.617000 |
GNGJWPZEJKPGFY-BDPMCISCSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304892; PubChem:CID118170712
|
Local ready
Direct docking supported
|
|
E3L013555
BDB013555
|
US10144731, Example 198
CCn1cc(CCC(CC(=O)O)c2ccc(C(F)(F)F)c(CN3CC(C)Cc4ccccc4S3(=O)=O)c2)nn1
|
C27H31F3N4O4S 564.630000 |
LJYJNPDCJALUPO-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304893; PubChem:CID118170949
|
Local ready
Direct docking supported
|
|
E3L013556
BDB013556
|
US10144731, Example 199
CC[C@H]1Cc2ccncc2S(=O)(=O)N(Cc2cc(C(CCc3cn(CC)nn3)CC(=O)O)ccc2C)C1
|
C27H35N5O4S 525.675000 |
ZEXIQZWCZZOHLR-AIBWNMTMSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304894; PubChem:CID122660642
|
Local ready
Direct docking supported
|
|
E3L013557
BDB013557
|
US10144731, Example 200
CC[C@@H]1CN(Cc2cc(C(CCc3cn(CC)nn3)CC(=O)O)ccc2C(F)(F)F)S(=O)(=O)c2ccccc2O1
|
C27H31F3N4O5S 580.629000 |
GJIAQUPOXRGEOW-AVKWCDSFSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304895; PubChem:CID118170268
|
Local ready
Direct docking supported
|
|
E3L013558
BDB013558
|
US10144731, Example 201
CCCn1cc(CCC(CC(=O)O)c2ccc(C)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)nn1
|
C27H34N4O5S 526.659000 |
DHXVRUGBGUAPNG-PSDZMVHGSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304896; PubChem:CID118169970
|
Local ready
Direct docking supported
|
|
E3L013559
BDB013559
|
US10144731, Example 202
CCCn1cc(CCC(CC(=O)O)c2ccc(C)c(CN3C[C@@H](CC)Oc4ccccc4S3(=O)=O)c2)nn1
|
C28H36N4O5S 540.686000 |
FGASSPDBSDOEPX-NRWPOFLRSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304897; PubChem:CID118170142
|
Local ready
Direct docking supported
|
|
E3L013560
BDB013560
|
US10144731, Example 203
Cc1ccc(C(CCc2cn(C(C)C)nn2)CC(=O)O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C27H34N4O5S 526.659000 |
GNXFBTOJIPLCGB-PSDZMVHGSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304898; PubChem:CID118170243
|
Local ready
Direct docking supported
|