Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 14/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20653077 | 0.86 | P2RX3 (0.47) | P2RX3SMN1; SMN2TSHRMAPT | |
| SCHEMBL20653078 | 0.84 | P2RX3 (0.51) | P2RX3SMN1; SMN2MAPT | |
| SCHEMBL20655939 | 0.84 | P2RX3 (0.43) | P2RX3MAPK1 | |
| SCHEMBL20656002 | 0.82 | P2RX3 (0.45) | P2RX3ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL24095610 | 0.80 | P2RX3 (0.42) | P2RX3ALDH1A1SMN1; SMN2MAPK1L3MBTL1 | |
| SCHEMBL20652792 | 0.79 | PDE5A (0.43) | P2RX3MAPK1L3MBTL1 | |
| SCHEMBL20656190 | 0.78 | P2RX3 (0.34) | P2RX3 | |
| SCHEMBL20652775 | 0.78 | P2RX3 (0.45) | P2RX3ALDH1A1SMN1; SMN2MAPK1L3MBTL1 | |
| SCHEMBL18833876 | 0.77 | P2RX3 (0.53) | P2RX3SMN1; SMN2MAPT | |
| SCHEMBL20432229 | 0.77 | P2RX3 (0.49) | P2RX3ALDH1A1SMN1; SMN2MEN1KMT2A |
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-2019011802-A1 | NOVEL SUBSTITUTED XANTHINE DERIVATIVES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2019-01-17 | — | — | WO | disclosed |