Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Propane SCHEMBL4897787 | 1.00 | CYP3A4 (0.58) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| SCHEMBL23721668 | 0.90 | CYP3A4 (0.61) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| SCHEMBL241534 | 0.90 | CYP3A4 (0.61) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| Water SCHEMBL3898007 | 0.87 | CYP3A4 (0.58) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| Hydrogen Sulfide SCHEMBL3894665 | 0.87 | CYP3A4 (0.58) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| Ether SCHEMBL3898004 | 0.87 | CYP3A4 (0.50) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| Butane SCHEMBL16872374 | 0.85 | CYP3A4 (0.62) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| SCHEMBL7585383 | 0.84 | CYP3A4 (0.50) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| SCHEMBL2114610 | 0.83 | CYP3A4 (0.54) | CYP3A4TSHRTRPA1TDP1GABRA1 | |
| SCHEMBL22966327 | 0.82 | CYP3A4 (0.87) | CYP3A4TSHRTRPA1TDP1GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0277376-B1 | AROMATIC AMIDE GROUPS-CONTAINING DIAMINES AND POLYMERS IN WHICH THESE DIAMINES ARE INCORPORATED | AKZO N.V. (NL) | 1991-02-27 | — | — | EP | disclosed |
| US-4980444-A | Polyamides, polyureas, polyimides; heat resistance, melt processability, high strength fibers, films | AKZO N.V. (NL) | 1990-12-25 | — | — | US | disclosed |
| US-4851562-A | HEAT RESISTANCE, MELT PROCESS ABILITY | AKZO N.V. (NL) | 1989-07-25 | — | — | US | disclosed |