Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8944354 | 0.94 | TSHR (0.49) | ALDH1A1KDM4ESMN1; SMN2MAPTTSHR | |
| SCHEMBL8944288 | 0.91 | NQO1 (0.61) | NQO1ALDH1A1KDM4ESMN1; SMN2MAPT | |
| SCHEMBL8943626 | 0.91 | NQO1 (0.61) | NQO1ALDH1A1KDM4ESMN1; SMN2MAPT | |
| SCHEMBL8943807 | 0.87 | AHR (0.53) | MAPTTSHRLTA4HCYP3A4AHR | |
| SCHEMBL8944313 | 0.87 | AHR (0.53) | MAPTTSHRLTA4HCYP3A4AHR | |
| SCHEMBL8944178 | 0.87 | LTA4H (0.55) | NQO1ALDH1A1KDM4ESMN1; SMN2MAPT | |
| SCHEMBL8943762 | 0.85 | MAPT (0.54) | ALDH1A1KDM4ESMN1; SMN2MAPTTSHR | |
| 1-Methoxy-4-Propoxybenzene SCHEMBL1324557 | 0.84 | LTA4H (0.57) | SMN1; SMN2MAPTTSHRLMNAHTT | |
| SCHEMBL8944174 | 0.84 | NR5A1 (0.55) | MAPTGAATSHRLMNALTA4H | |
| SCHEMBL8944204 | 0.84 | ACHE (0.56) | NQO1ALDH1A1MAPTGAATSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5480765-A | PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND | FUJI PHOTO FILM CO., LTD. (JP) | 1996-01-02 | — | — | US | disclosed |