Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 17/20 | 0.55 |
| ▸ | MAOB | P27338 | 17/20 | 0.55 |
| ▸ | PRKCI | P41743 | 1/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6421289 | 0.80 | STS (0.50) | — | |
| SCHEMBL115638 | 0.79 | MAOA (0.58) | MAOAMAOBPRKCIHSD17B1 | |
| SCHEMBL11746728 | 0.79 | MAOA (0.57) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL16471649 | 0.76 | PBRM1 (0.50) | MAOAMAOB | |
| SCHEMBL1495967 | 0.76 | MAOA (0.58) | MAOAMAOBPRKCIHSD17B1 | |
| SCHEMBL29756894 | 0.76 | MAOA (0.58) | MAOAMAOBPRKCIHSD17B1 | |
| SCHEMBL3821515 | 0.75 | MAOB (0.55) | MAOAMAOBPRKCIHSD17B1 | |
| SCHEMBL11741286 | 0.75 | MAOA (0.54) | MAOAMAOBPRKCIHSD17B1 | |
| SCHEMBL3275944 | 0.75 | MAOB (0.55) | MAOAMAOBPRKCIHSD17B1 | |
| SCHEMBL20211855 | 0.75 | MAOB (0.55) | MAOAMAOBPRKCIHSD17B1 |
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-4016281-A | Tetralone and indanone compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-04-05 | — | — | US | disclosed |