Gene Set: D4 : TTD - IDD552
| Collection |
D4 : TTD |
| Chemical Name |
IDD552 ( From PubChem : C H E M B L 3 9 9 5 9 8 ) |
| 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 |
| 414.331 g/mol |
2 |
7 |
3.637 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 7 H 1 0 F 4 N 2 O 4 S / c 1 8 - 7 - 1 - 2 - 8 ( 1 1 ( 3 - 7 ) 2 7 - 6 - 1 3 ( 2 4 ) 2 5 ) 1 7 ( 2 6 ) 2 2 - 5 - 1 2 - 2 3 - 1 5 - 1 4 ( 2 1 ) 9 ( 1 9 ) 4 - 1 0 ( 2 0 ) 1 6 ( 1 5 ) 2 8 - 1 2 / h 1 - 4 H , 5 - 6 H 2 , ( H , 2 2 , 2 6 ) ( H , 2 4 , 2 5 ) |
| InChIKey |
Z C A G E X Z T O R J Q D Z - U H F F F A O Y S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | AKR1B1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
Contact us
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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