Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5618611 | 0.84 | ALDH1A1 (0.50) | ADORA3ACHEMAOAMAOBHTT | |
| SCHEMBL5617520 | 0.83 | MAPT (0.55) | ADORA3MAOBNPC1RAB9AHTT | |
| SCHEMBL9695046 | 0.82 | MAPT (0.53) | MAOAMAOBHTTMAPTALDH1A1 | |
| SCHEMBL9695117 | 0.82 | ALDH1A1 (0.47) | MAOAMAOBHTTMAPTALDH1A1 | |
| SCHEMBL9695076 | 0.82 | BRD4 (0.53) | MAOAMAOBHTTMAPTALDH1A1 | |
| SCHEMBL5618509 | 0.80 | ALDH1A1 (0.45) | MAOAMAOBHTTABCC1ABCG2 | |
| SCHEMBL9695091 | 0.80 | ALDH1A1 (0.52) | MAOAMAOBHTTABCC1ABCG2 | |
| SCHEMBL5618038 | 0.80 | ALDH1A1 (0.48) | ACHEMAOAMAOBHTTMAPT | |
| SCHEMBL9589008 | 0.79 | CYP1A2 (0.47) | HTTMAPTALDH1A1HPGDKDM4E | |
| SCHEMBL5617678 | 0.79 | ALDH1A1 (0.51) | MAOBRAB9AHTTABCC1MAPT |
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-5100914-A | Monoamine Oxidase Inhibitors, Central Nervous System Disorders | BASF AKTIENGESELLSCHAFT (DE) | 1992-03-31 | — | — | US | disclosed |