| Collection |
D4 : TTD |
| Chemical Name |
Nilotinib ( From PubChem : N I L O T I N I B ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Not | Approved | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 529.516 g/mol |
2 |
7 |
6.5018 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 8 H 2 2 F 3 N 7 O / c 1 - 1 7 - 5 - 6 - 1 9 ( 1 0 - 2 5 ( 1 7 ) 3 7 - 2 7 - 3 3 - 9 - 7 - 2 4 ( 3 6 - 2 7 ) 2 0 - 4 - 3 - 8 - 3 2 - 1 4 - 2 0 ) 2 6 ( 3 9 ) 3 5 - 2 2 - 1 1 - 2 1 ( 2 8 ( 2 9 , 3 0 ) 3 1 ) 1 2 - 2 3 ( 1 3 - 2 2 ) 3 8 - 1 5 - 1 8 ( 2 ) 3 4 - 1 6 - 3 8 / h 3 - 1 6 H , 1 - 2 H 3 , ( H , 3 5 , 3 9 ) ( H , 3 3 , 3 6 , 3 7 ) |
| InChIKey |
H H Z I U R L S W U I H R B - U H F F F A O Y S A - N
|
| Links |
|
Gene
(3 /
9)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Multitarget | ABL1 | | | Successful target | | TTD | Inhibitor | ABL1 | | | Successful target | | TTD | Drug(s) | ABL1 | | | Successful target | | TTD | Multitarget | ABL2 | | | Successful target | | TTD | Inhibitor | ABL2 | | | Successful target | | TTD | Drug(s) | ABL2 | | | Successful target | | TTD | Multitarget | KIT | | | Successful target | | TTD | Inhibitor | KIT | | | Successful target | | TTD | Drug(s) | KIT | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
