Gene Set: D4 : TTD - (E)-1-Adamantan-1-yl-3-quinolin-3-yl-propenone
| Collection |
D4 : TTD |
| Chemical Name |
(E)-1-Adamantan-1-yl-3-quinolin-3-yl-propenone ( From PubChem : C H E M B L 5 5 4 7 0 0 ) |
| 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 |
| 317.424 g/mol |
0 |
2 |
5.0335 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 2 3 N O / c 2 4 - 2 1 ( 2 2 - 1 1 - 1 6 - 7 - 1 7 ( 1 2 - 2 2 ) 9 - 1 8 ( 8 - 1 6 ) 1 3 - 2 2 ) 6 - 5 - 1 5 - 1 0 - 1 9 - 3 - 1 - 2 - 4 - 2 0 ( 1 9 ) 2 3 - 1 4 - 1 5 / h 1 - 6 , 1 0 , 1 4 , 1 6 - 1 8 H , 7 - 9 , 1 1 - 1 3 H 2 / b 6 - 5 + / t 1 6 - , 1 7 + , 1 8 - , 2 2 - |
| InChIKey |
I H M K N C C P Y W K V E H - Q P V Q Z U S S S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | GRM1 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
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Tan Lab , Mail Stop 8117
12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA
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