Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 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 | |
|---|---|---|---|---|
| SCHEMBL11550598 | 1.00 | ALDH1A1 (0.41) | ALDH1A1LMNACYP3A4TDP1CYP1A1 | |
| SCHEMBL22117350 | 0.85 | NPSR1 (0.40) | ALDH1A1LMNACYP3A4TDP1CYP1A1 | |
| SCHEMBL22117349 | 0.85 | NPSR1 (0.40) | ALDH1A1LMNACYP3A4TDP1CYP1A1 | |
| Cyclopropane SCHEMBL11756493 | 0.84 | ALDH1A1 (0.47) | ALDH1A1LMNACYP3A4TDP1 | |
| SCHEMBL11550538 | 0.82 | CYP1A1 (0.32) | ALDH1A1LMNACYP3A4TDP1CYP1A1 | |
| SCHEMBL11550537 | 0.82 | CYP1A1 (0.32) | ALDH1A1LMNACYP3A4TDP1CYP1A1 | |
| SCHEMBL11232780 | 0.79 | ALDH1A1 (0.39) | ALDH1A1LMNACYP3A4TDP1 | |
| SCHEMBL11708260 | 0.78 | KDM1A (0.40) | ALDH1A1LMNACYP3A4TDP1 | |
| SCHEMBL11708252 | 0.78 | KDM1A (0.40) | ALDH1A1LMNACYP3A4TDP1 | |
| SCHEMBL11551792 | 0.78 | ALDH1A1 (0.30) | ALDH1A1LMNACYP3A4TDP1 |
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-4137273-A | INSECTICIDES, CHEMICAL INTERMEDIATES | ZOECON CORPORATION (US) | 1979-01-30 | — | — | US | disclosed |