Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL11871098 | 1.00 | ALDH1A1 (0.47) | ALDH1A1LMNACYP3A4TDP1KEAP1 | |
| SCHEMBL11868851 | 0.87 | ALDH1A1 (0.44) | ALDH1A1LMNACYP3A4TDP1 | |
| SCHEMBL11858937 | 0.87 | ALDH1A1 (0.50) | ALDH1A1LMNACYP3A4TDP1ALOX15 | |
| SCHEMBL11858941 | 0.87 | ALDH1A1 (0.50) | ALDH1A1LMNACYP3A4TDP1ALOX15 | |
| SCHEMBL11868856 | 0.87 | ALDH1A1 (0.44) | ALDH1A1LMNACYP3A4TDP1 | |
| SCHEMBL11855543 | 0.85 | ALDH1A1 (0.42) | ALDH1A1LMNACYP3A4TDP1HCAR2 | |
| SCHEMBL11855552 | 0.85 | ALDH1A1 (0.42) | ALDH1A1LMNACYP3A4TDP1HCAR2 | |
| SCHEMBL11853807 | 0.83 | ALDH1A1 (0.39) | ALDH1A1LMNACYP3A4TDP1ALOX15 | |
| SCHEMBL11853803 | 0.83 | ALDH1A1 (0.39) | ALDH1A1LMNACYP3A4TDP1ALOX15 | |
| SCHEMBL11867205 | 0.82 | KDM4E (0.42) | 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-3970704-A | Alkoxy substituted aliphatic di-olefinic halides | ZOECON CORPORATION (US) | 1976-07-20 | — | — | US | disclosed |