Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 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 | |
|---|---|---|---|---|
| SCHEMBL21173484 | 0.90 | ALDH1A1 (0.50) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13367671 | 0.90 | ALDH1A1 (0.50) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL12533929 | 0.84 | PTGS2 (0.47) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL21236831 | 0.83 | ALDH1A1 (0.56) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7788623 | 0.83 | ALDH1A1 (0.56) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL12336992 | 0.83 | ALDH1A1 (0.56) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL19687714 | 0.79 | EGFR (0.41) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL487511 | 0.78 | — | — | |
| SCHEMBL8943689 | 0.78 | CYP1A2 (0.53) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8577963 | 0.78 | ALDH1A1 (0.44) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 |
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-3522191-A1 | PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE SOLUTION, AND OXIDE SEMICONDUCTOR ELECTRODE | FUJIFILM Corporation (JP) | 2019-08-07 | — | — | EP | disclosed |