Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29155067 | 0.89 | PTK2 (0.41) | ALDH1A1PTK2RAB9ANPC1TDP1 | |
| SCHEMBL19385660 | 0.83 | CYP11B1 (0.49) | PTK2NPC1TDP1L3MBTL1PTGS2 | |
| SCHEMBL13172597 | 0.83 | MAPT (0.50) | ALDH1A1RAB9ATDP1MAPTPOLB | |
| SCHEMBL30106072 | 0.82 | HSP90AB1 (0.47) | ALDH1A1RAB9ANPC1 | |
| SCHEMBL15710323 | 0.82 | HSP90AB1 (0.47) | ALDH1A1RAB9ANPC1 | |
| SCHEMBL10174364 | 0.81 | RAB9A (0.44) | ALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL26046019 | 0.80 | TDP1 (0.51) | ALDH1A1PTK2RAB9ANPC1TDP1 | |
| SCHEMBL9267515 | 0.79 | MBOAT4 (0.42) | ALDH1A1RAB9ANPC1MAPTTP53 | |
| SCHEMBL31028364 | 0.79 | MBOAT4 (0.42) | ALDH1A1RAB9ANPC1MAPTTP53 | |
| SCHEMBL30094494 | 0.79 | KDM4E (0.42) | ALDH1A1RAB9ANPC1L3MBTL1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111116576-A | Quinolizinone compound and preparation method thereof | 北京师范大学 | 2020-05-08 | — | — | CN | disclosed |
| CN-106349156-A | Pyridine-2-amides capable of being used as CB2 agonist | 霍夫曼-拉罗奇有限公司 | 2017-01-25 | — | — | CN | disclosed |
| CN-103608332-B | Pyridine-2-amides useful as CB2 agonists | 霍夫曼-拉罗奇有限公司 | 2016-09-28 | — | — | CN | disclosed |