Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 13/20 | 0.55 |
| ▸ | HPGD | P15428 | 11/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 10/20 | 0.55 |
| ▸ | NPC1 | O15118 | 9/20 | 0.55 |
| ▸ | RAB9A | P51151 | 8/20 | 0.55 |
| ▸ | STAT3 | P40763 | 1/20 | 0.51 |
| ▸ | STAT1 | P42224 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.47 |
| ▸ | USP2 | O75604 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | PPARG | P37231 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29479791 | 1.00 | ALDH1A1 (0.55) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL23033451 | 0.96 | NPC1 (0.59) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL28707250 | 0.89 | NPC1 (0.54) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL29479722 | 0.89 | NPC1 (0.54) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL29479631 | 0.87 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL23012282 | 0.87 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL28706406 | 0.87 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL23012294 | 0.85 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL30850818 | 0.85 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL23033694 | 0.84 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114269725-A | Anti-influenza virus compound and preparation method and application thereof | 四川海思科制药有限公司 | 2022-04-01 | — | — | CN | disclosed |
| WO-2021032209-A1 | ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF | 四川海思科制药有限公司 | 2021-02-25 | — | — | WO | disclosed |