Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.54 |
| ▸ | RAB9A | P51151 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.51 |
| ▸ | HPGD | P15428 | 7/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | STAT3 | P40763 | 1/20 | 0.51 |
| ▸ | STAT1 | P42224 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.47 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.46 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29479722 | 1.00 | NPC1 (0.54) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL29479791 | 0.89 | ALDH1A1 (0.55) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL23012931 | 0.89 | ALDH1A1 (0.55) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL28713327 | 0.88 | KDM4E (0.61) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL28713324 | 0.88 | KDM4E (0.61) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL30297422 | 0.88 | KDM4E (0.61) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL23012967 | 0.86 | MAPT (0.51) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL29479590 | 0.86 | MAPT (0.51) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL23012765 | 0.86 | MAPT (0.51) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL23033451 | 0.85 | NPC1 (0.59) | NPC1RAB9AMAPTKDM4EALDH1A1 |
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-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 |