Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL11575222 | 0.78 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL19217559 | 0.76 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL18473954 | 0.76 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL13334597 | 0.76 | ESR1 (0.35) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL8739143 | 0.76 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL15383 | 0.76 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL8739288 | 0.76 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL21147091 | 0.76 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL20604028 | 0.76 | ALDH1A1 (0.33) | ALDH1A1CYP3A4MEN1KMT2A | |
| SCHEMBL24030719 | 0.74 | FUCA1 (0.34) | ALDH1A1CYP3A4MEN1KMT2A |
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-0757980-A1 | Process for the preparation of 3-aminomethyl-3,5,5-trimethyl cyclohexylamine | BASF AKTIENGESELLSCHAFT (DE) | 1997-02-12 | — | — | EP | disclosed |