Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5109272 | 0.91 | CYP3A4 (0.52) | CYP3A4CYP2C19ALDH1A1MAPTTP53 | |
| SCHEMBL8916260 | 0.89 | MAPT (0.54) | CYP3A4CYP2C19ALDH1A1MAPTTP53 | |
| SCHEMBL8914486 | 0.87 | KDM4E (0.49) | CYP3A4CYP2C19ALDH1A1MAPTTP53 | |
| SCHEMBL8914183 | 0.84 | GAA (0.50) | ALDH1A1MAPTPOLBGAAKDM4E | |
| SCHEMBL8914024 | 0.82 | L3MBTL1 (0.45) | ALDH1A1MAPTTP53GAAKDM4E | |
| SCHEMBL5106665 | 0.81 | PDE10A (0.43) | CYP3A4CYP2C19ALDH1A1MAPTTP53 | |
| SCHEMBL5120357 | 0.80 | PDE10A (0.42) | CYP3A4CYP2C19ALDH1A1MAPTTP53 | |
| SCHEMBL8915606 | 0.73 | RAB9A (0.69) | CYP3A4CYP2C19ALDH1A1MAPTHPGD | |
| SCHEMBL8916044 | 0.73 | USP2 (0.49) | ALDH1A1MAPTTP53GAALMNA | |
| SCHEMBL9213950 | 0.72 | PDE10A (0.41) | ALDH1A1MAPTTP53POLBLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5616581-A | BACTERICIDES | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1997-04-01 | — | — | US | disclosed |
| US-5504082-A | BACTERICIDE FOR HELICOBACTER, ANTIULCER AGENT, GASTRIC ACIDSUPPRESSOR | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1996-04-02 | — | — | US | disclosed |
| EP-0644191-A1 | PYRIDINE COMPOUND AND MEDICINAL USE THEREOF | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1995-03-22 | — | — | EP | disclosed |