Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11849635 | 0.83 | HTR3E (0.30) | — | |
| SCHEMBL29808667 | 0.83 | CYP3A4 (0.50) | CYP3A4TRPA1TDP1ALDH1A1HPGD | |
| SCHEMBL29716699 | 0.83 | CYP3A4 (0.50) | CYP3A4TRPA1TDP1ALDH1A1HPGD | |
| SCHEMBL10408265 | 0.83 | CYP3A4 (0.50) | CYP3A4TRPA1TDP1ALDH1A1HPGD | |
| SCHEMBL8937141 | 0.83 | CYP3A4 (0.50) | CYP3A4TRPA1TDP1ALDH1A1HPGD | |
| SCHEMBL623608 | 0.79 | CYP3A4 (0.52) | CYP3A4TRPA1TDP1ALDH1A1HPGD | |
| SCHEMBL28264037 | 0.79 | CYP3A4 (0.47) | CYP3A4TRPA1TDP1ALDH1A1HPGD | |
| SCHEMBL28766794 | 0.79 | ALDH1A1 (0.47) | CYP3A4TRPA1TDP1ALDH1A1HPGD | |
| SCHEMBL19713002 | 0.77 | CYP3A4 (0.41) | CYP3A4TDP1HPGDMAPK1 | |
| SCHEMBL15431 | 0.77 | CYP3A4 (0.64) | CYP3A4TRPA1TDP1ALDH1A1HPGD |
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-0025500-A1 | Process for producing an adhering polyurethane or polyurea elastomer film on shaped rubber articles | METZELER KAUTSCHUK GMBH (DE) | 1981-03-25 | — | — | EP | disclosed |