Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.44 |
| ▸ | CHKA | P35790 | 3/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20037592 | 0.96 | ALDH1A1 (0.50) | ALDH1A1PKMMEN1KMT2AGAA | |
| SCHEMBL12028959 | 0.89 | HRH3 (0.47) | ALDH1A1MEN1KMT2AHRH3CHKA | |
| SCHEMBL21414387 | 0.86 | CHKA (0.57) | HRH3CHKALMNACA2NCF1 | |
| SCHEMBL4547913 | 0.86 | HRH3 (0.50) | ALDH1A1HRH3PRMT5WDR77TSHR | |
| SCHEMBL25896863 | 0.84 | HRH3 (0.53) | ALDH1A1MEN1KMT2AHRH3TSHR | |
| SCHEMBL21414349 | 0.84 | ALDH1A1 (0.50) | ALDH1A1PKMMEN1KMT2AGAA | |
| SCHEMBL17660303 | 0.83 | LMNA (0.50) | ALDH1A1MEN1KMT2ANPC1TP53 | |
| SCHEMBL22876978 | 0.83 | ALDH1A1 (0.51) | ALDH1A1PKMMEN1KMT2AGAA | |
| SCHEMBL18291450 | 0.82 | ALDH1A1 (0.50) | ALDH1A1PKMMEN1KMT2AGAA | |
| SCHEMBL20037661 | 0.82 | PRMT5 (0.38) | ALDH1A1PKMMEN1KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3546458-A1 | PYRIDO[3, 4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | Teijin Pharma Limited (JP) | 2019-10-02 | — | — | EP | disclosed |