Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 8/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | UTRN | P46939 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GRK2 | P25098 | 2/20 | 0.41 |
| ▸ | GRK5 | P34947 | 2/20 | 0.41 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | PTPRF | P10586 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29479594 | 0.87 | HDAC6 (0.46) | S1PR1S1PR3HDAC6UTRNKDM4E | |
| SCHEMBL23012339 | 0.87 | HDAC6 (0.46) | S1PR1S1PR3HDAC6UTRNKDM4E | |
| SCHEMBL23012861 | 0.84 | ALDH1A1 (0.43) | S1PR1S1PR3UTRNKDM4EMEN1 | |
| SCHEMBL28707273 | 0.83 | POLB (0.50) | S1PR1S1PR3HDAC6KDM4EMEN1 | |
| SCHEMBL29479610 | 0.83 | POLB (0.50) | S1PR1S1PR3HDAC6KDM4EMEN1 | |
| SCHEMBL1675431 | 0.82 | KDM4E (0.54) | S1PR1S1PR3HDAC6UTRNKDM4E | |
| SCHEMBL28695313 | 0.82 | S1PR1 (0.43) | S1PR1S1PR3HDAC6UTRNKDM4E | |
| SCHEMBL29479840 | 0.80 | PIK3CB (0.57) | S1PR1HDAC6UTRNKDM4ENPC1 | |
| SCHEMBL23012902 | 0.79 | PIK3CA (0.63) | HDAC6KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL29479649 | 0.79 | PIK3CA (0.63) | HDAC6KDM4EMEN1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |