Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.39 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.38 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.35 |
| ▸ | ATIC | P31939 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20420026 | 0.85 | KDM4E (0.61) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL20419978 | 0.85 | KDM4E (0.61) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL20419988 | 0.84 | KDM4E (0.62) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL12631747 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL12801376 | 0.81 | PI4KA (0.64) | RXFP1P2RX1P2RX3P2RX4PI4KA | |
| SCHEMBL20419936 | 0.80 | ALDH1A1 (0.65) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL12631756 | 0.80 | ALDH1A1 (0.65) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL13169967 | 0.79 | RXFP1 (0.52) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL12631748 | 0.79 | P2RX3 (0.51) | ALDH1A1KDM4EGAAHTTBLM | |
| SCHEMBL31734837 | 0.74 | ADORA3 (0.56) | RXFP1 |
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-2018134399-A1 | NOVEL PRODRUGS OF MIZORIBINE | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2018-07-26 | — | — | WO | disclosed |