Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7064746 | 0.81 | ALDH1A1 (0.34) | ALDH1A1NR1H2NR1H3 | |
| Hydrochloric Acid SCHEMBL27258912 | 0.81 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL10913604 | 0.79 | ALDH1A1 (0.39) | ALDH1A1NR1H2NR1H3 | |
| SCHEMBL8522100 | 0.78 | KCNH2 (0.36) | ALDH1A1 | |
| SCHEMBL8192574 | 0.78 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL27259117 | 0.78 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL18135557 | 0.77 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL31468636 | 0.77 | HRH1 (0.34) | ALDH1A1 | |
| SCHEMBL31468473 | 0.75 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL8524028 | 0.75 | NR1H2 (0.37) | ALDH1A1NR1H2NR1H3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1023485-C | Process for preparing substituted silylalkyleneamines | MERRELL DOW PHARMA (US) | 1994-01-12 | — | — | CN | disclosed |
| CN-88102628-A | Novel substituted silylalkyleneamines | — | 1988-11-30 | — | — | CN | disclosed |