| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L027701
BDB027701
|
US11458138, Example 101
OCC1(Nc2nc(-c3ccncc3)nc3cnccc23)CCC1
|
C17H17N5O 307.357000 |
RQXXATOWBUCCAY-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574272; PubChem:CID145744559
|
Local ready
Direct docking supported
|
|
E3L027702
BDB027702
|
US11458138, Example 102
COC(=O)CC1(Nc2nc(-c3ccncc3)nc3cnccc23)CC1
|
C18H17N5O2 335.367000 |
DZWNHFKYWRKAEV-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574273; PubChem:CID145744613
|
Local ready
Direct docking supported
|
|
E3L027703
BDB027703
|
US11458138, Example 103
CC(C)CNc1nc(-c2ccncc2)nc2cnccc12
|
C16H17N5 279.347000 |
USDKWKYOYBOASS-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574274; PubChem:CID135368399
|
Local ready
Direct docking supported
|
|
E3L027704
BDB027704
|
US11458138, Example 104
CC(C)(CC#N)Nc1nc(-c2ccncc2)nc2cnccc12
|
C17H16N6 304.357000 |
JTPSWFVPTPXJQK-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574275; PubChem:CID145744597
|
Local ready
Direct docking supported
|
|
E3L027705
BDB027705
|
US11458138, Example 105
NCCCCCNc1nc(-c2ccncc2)nc2cnccc12
|
C17H20N6 308.389000 |
CIRBVQGXQHQPPJ-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574276; PubChem:CID145744611
|
Local ready
Direct docking supported
|
|
E3L027706
BDB027706
|
US11458138, Example 106
NCCCCNc1nc(-c2ccncc2)nc2cnccc12
|
C16H18N6 294.362000 |
HXPKGSVUBKACMM-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574277; PubChem:CID145744569
|
Local ready
Direct docking supported
|
|
E3L027707
BDB027707
|
US11458138, Example 107
CC(C)(C#N)Nc1nc(-c2ccncc2)nc2cnccc12
|
C16H14N6 290.330000 |
ZSIFZCVWFFEAEP-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574278; PubChem:CID135368688
|
Local ready
Direct docking supported
|
|
E3L027708
BDB027708
|
US11458138, Example 108
CC1CCCCN1CC(C)(C)Nc1nc(-c2ccncc2)nc2cnccc12
|
C22H28N6 376.508000 |
BVZOPNAVHMIKMP-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574279; PubChem:CID145744601
|
Local ready
Direct docking supported
|
|
E3L027709
BDB027709
|
US11458138, Example 109
CN(C)CCC(C)(C)Nc1nc(-c2ccncc2)nc2cnccc12
|
C19H24N6 336.443000 |
QLNKJSSYMWYESY-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574280; PubChem:CID135390261
|
Local ready
Direct docking supported
|
|
E3L027710
BDB027710
|
US11458138, Example 110
CC(C)(CN)Nc1nc(-c2ccncc2)nc2cnccc12
|
C16H18N6 294.362000 |
CKGSKEKFMDASMJ-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574281; PubChem:CID135368301
|
Local ready
Direct docking supported
|
|
E3L027711
BDB027711
|
US11458138, Example 111
FC(F)(F)c1n[nH]cc1-c1nc(NC2CCCC2)c2ccncc2n1
|
C16H15F3N6 348.332000 |
UFYSVZDHPHLSEY-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574282; PubChem:CID137350716
|
Local ready
Direct docking supported
|
|
E3L027712
BDB027712
|
US11458138, Example 112
CC(C)(C)Nc1nc(-c2ccnc(N)c2)nc2cnccc12
|
C16H18N6 294.362000 |
YNBSFECDNZVJCQ-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574283; PubChem:CID145744623
|
Local ready
Direct docking supported
|
|
E3L027713
BDB027713
|
US11458138, Example 113
Cc1c(-c2nc(NC(C)(C)C)c3ccncc3n2)c2cccnc2n1S(=O)(=O)c1ccccc1
|
C25H24N6O2S 472.574000 |
WYVPBNVTWUFUIA-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574284; PubChem:CID137350580
|
Local ready
Direct docking supported
|
|
E3L027714
BDB027714
|
US11458138, Example 114
Cc1ccc(S(=O)(=O)n2c(C)c(-c3nc(NC(C)(C)C)c4ccncc4n3)c3cccnc32)cc1
|
C26H26N6O2S 486.601000 |
KXSUMCWTBFNYKH-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574285; PubChem:CID145744558
|
Local ready
Direct docking supported
|
|
E3L027715
BDB027715
|
US11458138, Example 115
CC(C)(C)Nc1nc(-c2c[nH]nc2C(F)(F)F)nc2cnccc12
|
C15H15F3N6 336.321000 |
VSSHCXZLCILCST-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574286; PubChem:CID135368367
|
Local ready
Direct docking supported
|
|
E3L027716
BDB027716
|
US11458138, Example 116
CC(C)(C)Nc1nc(-c2ccncc2Cl)nc2cnccc12
|
C16H16ClN5 313.792000 |
MBMKHDKGWLLWJM-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574287; PubChem:CID145744624
|
Local ready
Direct docking supported
|
|
E3L027717
BDB027717
|
US11458138, Example 117
Cc1cnccc1-c1nc(NC(C)(C)C)c2ccncc2n1
|
C17H19N5 293.374000 |
AXIUQLRGRRZPQS-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574288; PubChem:CID135368503
|
Local ready
Direct docking supported
|
|
E3L027718
BDB027718
|
US11458138, Example 118
CCC(C)(C)Nc1nc(-c2ccncc2Cl)nc2cnccc12
|
C17H18ClN5 327.819000 |
OXIMJDPCKQGAMC-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574289; PubChem:CID135368361
|
Local ready
Direct docking supported
|
|
E3L027719
BDB027719
|
US11458138, Example 119
CC(C)(O)CC(C)(C)Nc1nc(-c2c[nH]nc2C(F)(F)F)nc2cnccc12
|
C18H21F3N6O 394.401000 |
XFAFYUWFKMLDGN-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574290; PubChem:CID135390231
|
Local ready
Direct docking supported
|
|
E3L027720
BDB027720
|
US11458138, Example 120
CCN(c1nc(-c2ccncc2F)nc2cnccc12)C(C)C
|
C17H18FN5 311.364000 |
KLKUFMUKDOLUBI-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM574291; PubChem:CID145744591
|
Local ready
Direct docking supported
|