Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 4/20 | 0.55 |
| ▸ | HCAR3 | P49019 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | KAT2B | Q92831 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29154861 | 0.86 | KAT2B (0.64) | PRSS1HCAR3MAPTPOLBKDM4E | |
| SCHEMBL29154859 | 0.85 | PRSS1 (0.54) | PRSS1HCAR3MAPTPOLBKDM4E | |
| SCHEMBL28602327 | 0.85 | PRSS1 (0.62) | PRSS1HCAR3MAPTHTTKDM4E | |
| SCHEMBL1420938 | 0.82 | HCAR3 (0.58) | PRSS1HCAR3MAPTHTTPOLB | |
| SCHEMBL28721561 | 0.81 | PKM (0.62) | PRSS1HCAR3MAPTHTTKDM4E | |
| SCHEMBL4060611 | 0.79 | MAPT (0.58) | PRSS1HCAR3MAPTHTTPOLB | |
| SCHEMBL8336041 | 0.79 | ALDH1A1 (0.56) | PRSS1HCAR3MAPTHTTPOLB | |
| SCHEMBL30317060 | 0.78 | KAT2B (0.63) | PRSS1MAPTHTTKAT2BALDH1A1 | |
| SCHEMBL1170111 | 0.77 | HCAR3 (0.66) | PRSS1HCAR3MAPTHTTPOLB | |
| SCHEMBL30163832 | 0.76 | MAPT (0.53) | PRSS1HCAR3MAPTHTTPOLB |
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-117561262-A | Macrocyclic TAK1 inhibitors | 阿奎利恩有限公司 | 2024-02-13 | — | — | CN | disclosed |