Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GPX4 | P36969 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2526618 | 0.76 | MAPT (0.34) | MAPTKMT2AHDAC1HDAC6 | |
| SCHEMBL20038496 | 0.74 | CRHR1 (0.42) | MAPTKMT2ANPC1RAB9AHCAR3 | |
| SCHEMBL18155441 | 0.73 | TP53 (0.46) | TP53OPRM1MAPTNPC1ALDH1A1 | |
| SCHEMBL2069920 | 0.73 | TP53 (0.68) | TP53OPRM1KMT2ANPC1ALDH1A1 | |
| SCHEMBL20038047 | 0.72 | KMT2A (0.42) | MAPTKMT2AHDAC1HDAC6ALDH1A1 | |
| SCHEMBL10893728 | 0.71 | TRPM8 (0.55) | TP53OPRM1MAPTNPC1ALDH1A1 | |
| SCHEMBL3634800 | 0.69 | MLYCD (0.40) | MAPTKMT2AHDAC1HDAC6NPC1 | |
| SCHEMBL11367960 | 0.68 | NPC1 (0.64) | TP53OPRM1NPC1ALDH1A1GPX4 | |
| SCHEMBL5429491 | 0.68 | MLYCD (0.51) | TP53MAPTKMT2AHDAC1HDAC6 | |
| SCHEMBL14337547 | 0.68 | NOTUM (0.41) | HDAC1HDAC6ALDH1A1SMN1; SMN2 |
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-3305785-A1 | PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | Teijin Pharma Limited (JP) | 2018-04-11 | — | — | EP | disclosed |