| Collection |
D4 : TTD |
| Chemical Name |
GSK-1070916 ( From PubChem : G S K 1 0 7 0 9 1 6 ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Not | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 507.629 g/mol |
2 |
7 |
6.0084 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 0 H 3 3 N 7 O / c 1 - 6 - 3 7 - 1 9 - 2 6 ( 2 8 ( 3 4 - 3 7 ) 2 1 - 1 0 - 1 2 - 2 3 ( 1 3 - 1 1 - 2 1 ) 3 2 - 3 0 ( 3 8 ) 3 6 ( 4 ) 5 ) 2 4 - 1 4 - 1 5 - 3 1 - 2 9 - 2 5 ( 2 4 ) 1 7 - 2 7 ( 3 3 - 2 9 ) 2 2 - 9 - 7 - 8 - 2 0 ( 1 6 - 2 2 ) 1 8 - 3 5 ( 2 ) 3 / h 7 - 1 7 , 1 9 H , 6 , 1 8 H 2 , 1 - 5 H 3 , ( H , 3 1 , 3 3 ) ( H , 3 2 , 3 8 ) |
| InChIKey |
Q T B W C S Q G B M P E C M - U H F F F A O Y S A - N
|
| Links |
|
Gene
(5 /
11)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | AURKA | | | Clinical trial target | | TTD | Multitarget | AURKB | | | Clinical trial target | | TTD | Inhibitor | AURKB | | | Clinical trial target | | TTD | Drug(s) | AURKB | | | Clinical trial target | | TTD | Inhibitor | AURKB | | | Research target | | TTD | Multitarget | AURKC | | | Clinical trial target | | TTD | Inhibitor | AURKC | | | Clinical trial target | | TTD | Inhibitor | AURKC | | | Clinical trial target | | TTD | Drug(s) | AURKC | | | Clinical trial target | | TTD | Inhibitor | CYP2D6 | | | Successful target | | TTD | Inhibitor | CYP3A4 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
