Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8086282 | 0.92 | MAPT (0.44) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL4247305 | 0.87 | RAB9A (0.58) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL8086791 | 0.80 | NPC1 (0.51) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL4250840 | 0.79 | RAB9A (0.56) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL4249452 | 0.78 | MAPT (0.56) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL4254188 | 0.77 | RAB9A (0.56) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL8086177 | 0.75 | RAF1 (0.53) | NPC1ALDH1A1TAAR1 | |
| SCHEMBL4251690 | 0.75 | RAB9A (0.56) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL4247072 | 0.74 | RXFP1 (0.62) | RAB9ANPC1ALDH1A1TP53PKM | |
| SCHEMBL8091906 | 0.72 | NPC1 (0.56) | RAB9ANPC1ALDH1A1TP53PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009016088-A1 | THE USE OF BENZAMIDE DERIVATIVES FOR THE TREATMENT OF CNS DISORDERS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-02-05 | — | — | WO | disclosed |