Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | MAPT | P10636 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | NPC1 | O15118 | 4/20 | 0.61 |
| ▸ | RAB9A | P51151 | 4/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | AHR | P35869 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.50 |
| ▸ | AR | P10275 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 2/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28282946 | 0.81 | LMNA (0.73) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL28309786 | 0.80 | LMNA (0.71) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL5255345 | 0.80 | LMNA (0.71) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL5083062 | 0.80 | RAB9A (0.72) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL29898238 | 0.80 | LMNA (0.71) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL28949487 | 0.80 | LMNA (0.71) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL9496511 | 0.80 | LMNA (1.00) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL2714471 | 0.79 | LMNA (0.70) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL479805 | 0.79 | DHODH (0.76) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL28284428 | 0.78 | LMNA (0.68) | LMNAMAPTALDH1A1NPC1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106061967-B | The nicotinamide compounds replaced through heteroaryl | 百时美施贵宝公司 | 2019-04-19 | — | — | CN | claimed |