| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L000781
BDB000781
|
4-[(5-Bromo-1,3-thiazol-2-yl)amino]benzonitrile
N#Cc1ccc(Nc2ncc(Br)s2)cc1
|
C10H6BrN3S 280.150000 |
LGRGXAHTQGDCSK-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25668; PubChem:CID16068847
|
Local ready
Direct docking supported
|
|
E3L000782
BDB000782
|
4-[(5-Bromo-1,3-thiazol-2-yl)amino]phenol
Oc1ccc(Nc2ncc(Br)s2)cc1
|
C9H7BrN2OS 271.139000 |
AWMZASLWFWZYDR-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25669; PubChem:CID16068432
|
Local ready
Direct docking supported
|
|
E3L000783
BDB000783
|
(5-Bromo-thiazol-2-yl)-(4-methoxy-phenyl)-amine
COc1ccc(Nc2ncc(Br)s2)cc1
|
C10H9BrN2OS 285.166000 |
SVYOYUOJJWKYDW-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25670; PubChem:CID12348632
|
Local ready
Direct docking supported
|
|
E3L000784
BDB000784
|
BDBM25671
FC(F)(F)Oc1ccc(Nc2ncc(Br)s2)cc1
|
C10H6BrF3N2OS 339.136000 |
DWHXSOQDXRRHTP-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25671; PubChem:CID25093333
|
Local ready
Direct docking supported
|
|
E3L000785
BDB000785
|
5-bromo-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine
Brc1cnc(Nc2ccc(Oc3ccccc3)cc2)s1
|
C15H11BrN2OS 347.237000 |
DZGOYVWFZPLZDR-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25672; PubChem:CID16068854
|
Local ready
Direct docking supported
|
|
E3L000786
BDB000786
|
BDBM25673
Brc1cnc(Nc2ccc(Oc3ccncc3)cc2)s1
|
C14H10BrN3OS 348.225000 |
KESHTUVUCUFFBY-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25673; PubChem:CID16068631
|
Local ready
Direct docking supported
|
|
E3L000787
BDB000787
|
BDBM25674
CC(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C11H9BrN2OS 297.177000 |
IGLFYBIFTRNUCG-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25674; PubChem:CID16068736
|
Local ready
Direct docking supported
|
|
E3L000788
BDB000788
|
5-bromo-N-(4-nitrophenyl)-1,3-thiazol-2-amine
O=[N+]([O-])c1ccc(Nc2ncc(Br)s2)cc1
|
C9H6BrN3O2S 300.137000 |
KZBDTDUPILBSCQ-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25675; PubChem:CID16068855
|
Local ready
Direct docking supported
|
|
E3L000789
BDB000789
|
1-N-(5-bromo-1,3-thiazol-2-yl)benzene-1,4-diamine
Nc1ccc(Nc2ncc(Br)s2)cc1
|
C9H8BrN3S 270.155000 |
RDLRRWXLEXYXMJ-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25676; PubChem:CID16068735
|
Local ready
Direct docking supported
|
|
E3L000790
BDB000790
|
N-{4-[(5-bromo-1,3-thiazol-2-yl)amino]phenyl}benzamide
O=C(Nc1ccc(Nc2ncc(Br)s2)cc1)c1ccccc1
|
C16H12BrN3OS 374.263000 |
WJAAXNIZNKAKEV-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25677; PubChem:CID16068527
|
Local ready
Direct docking supported
|
|
E3L000791
BDB000791
|
N-{4-[(5-bromo-1,3-thiazol-2-yl)amino]phenyl}acetamide
CC(=O)Nc1ccc(Nc2ncc(Br)s2)cc1
|
C11H10BrN3OS 312.192000 |
QZEUOEMCXHAZTN-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25678; PubChem:CID16068528
|
Local ready
Direct docking supported
|
|
E3L000792
BDB000792
|
Ethyl 4-[(5-bromo-1,3-thiazol-2-yl)amino]benzoate
CCOC(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C12H11BrN2O2S 327.203000 |
UCNQZHJDGNKKCF-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25679; PubChem:CID16068737
|
Local ready
Direct docking supported
|
|
E3L000793
BDB000793
|
4-[(5-Bromo-1,3-thiazol-2-yl)amino]benzoic acid
O=C(O)c1ccc(Nc2ncc(Br)s2)cc1
|
C10H7BrN2O2S 299.149000 |
MEBBDDHYRXPAPC-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25680; PubChem:CID16068522
|
Local ready
Direct docking supported
|
|
E3L000794
BDB000794
|
4-[(5-Bromo-1,3-Thiazol-2-Yl)amino]-N-Methylbenzamide
CNC(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C11H10BrN3OS 312.192000 |
IMMYNZJEOGNQTM-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25681; PubChem:CID24180715
|
Local ready
Direct docking supported
|
|
E3L000795
BDB000795
|
BDBM25682
O=C(NCCO)c1ccc(Nc2ncc(Br)s2)cc1
|
C12H12BrN3O2S 342.218000 |
KKEQVLKXFRTVRA-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25682; PubChem:CID16068633
|
Local ready
Direct docking supported
|
|
E3L000796
BDB000796
|
BDBM25683
COCCNC(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C13H14BrN3O2S 356.245000 |
IWCFHNAKCXJGPF-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25683; PubChem:CID16068524
|
Local ready
Direct docking supported
|
|
E3L000797
BDB000797
|
BDBM25684
COCC(C)NC(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C14H16BrN3O2S 370.272000 |
HTRXXSQYQPXLSJ-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25684; PubChem:CID16068957
|
Local ready
Direct docking supported
|
|
E3L000798
BDB000798
|
BDBM25685
COCCN(C)C(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C14H16BrN3O2S 370.272000 |
OHMRCNZQBXVUFZ-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25685; PubChem:CID16068958
|
Local ready
Direct docking supported
|
|
E3L000799
BDB000799
|
BDBM25686
CN(C)CCNC(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C14H17BrN4OS 369.288000 |
PKPZNTJEXBRJFN-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25686; PubChem:CID16068634
|
Local ready
Direct docking supported
|
|
E3L000800
BDB000800
|
BDBM25687
CCN(CC)CCNC(=O)c1ccc(Nc2ncc(Br)s2)cc1
|
C16H21BrN4OS 397.342000 |
QXMILNSXEFNUCP-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM25687; PubChem:CID16068635
|
Local ready
Direct docking supported
|