Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12555016 | 1.00 | ALDH1A1 (0.47) | ALDH1A1THRBMEN1KMT2AALOX5 | |
| SCHEMBL9887510 | 1.00 | ALDH1A1 (0.47) | ALDH1A1THRBMEN1KMT2AALOX5 | |
| SCHEMBL9886936 | 1.00 | ALDH1A1 (0.47) | ALDH1A1THRBMEN1KMT2AALOX5 | |
| SCHEMBL1764748 | 1.00 | ALDH1A1 (0.47) | ALDH1A1THRBMEN1KMT2AALOX5 | |
| SCHEMBL24170123 | 0.97 | ALDH1A1 (0.44) | ALDH1A1THRBMEN1KMT2A | |
| SCHEMBL12540471 | 0.97 | ALDH1A1 (0.44) | ALDH1A1THRBMEN1KMT2A | |
| SCHEMBL12689882 | 0.97 | ALDH1A1 (0.44) | ALDH1A1THRBMEN1KMT2A | |
| SCHEMBL3844589 | 0.94 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL16512832 | 0.94 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL18506484 | 0.94 | ALDH1A1 (0.39) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0369335-B1 | 2-Aminodecaline derivatives and their use | BASF AG (DE) | 1994-02-23 | — | — | EP | claimed |
| US-5051409-A | Fungicides | BASF AKTIENGESELLSCHAFT (DE) | 1991-09-24 | — | — | US | disclosed |