Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.45 |
| ▸ | CASP3 | P42574 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10727427 | 1.00 | CA12 (0.53) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL10722449 | 0.85 | NPC1 (0.56) | ALDH1A1MEN1KMT2ACASP3RAB9A | |
| SCHEMBL9659771 | 0.81 | CA12 (0.51) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL12934074 | 0.81 | CA12 (0.51) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL30226782 | 0.81 | CA12 (0.51) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL1273992 | 0.81 | CA12 (0.51) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL22216369 | 0.81 | ALDH1A1 (0.53) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL22216426 | 0.81 | CA12 (0.51) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL22216274 | 0.81 | CA12 (0.51) | CA12CA9ALDH1A1NPSR1MEN1 | |
| SCHEMBL30226990 | 0.81 | CA12 (0.51) | CA12CA9ALDH1A1NPSR1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0067105-B1 | ALLYL AMINE MAO INHIBITORS | MERRELL DOW FRANCE ET CIE (FR) | 1987-09-23 | — | — | EP | disclosed |
| US-4454158-A | Allyl amine MAO inhibitors | MERRELL TORAUDE ET COMPAGNIE (FR) | 1984-06-12 | — | — | US | disclosed |
| EP-0067105-A2 | Allyl amine MAO inhibitors | MERRELL DOW FRANCE ET CIE (FR) | 1982-12-15 | — | — | EP | disclosed |