Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 6/20 | 0.52 |
| ▸ | RAB9A | P51151 | 6/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8071365 | 0.84 | NPC1 (0.56) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL4251069 | 0.83 | NPC1 (0.76) | ROCK2NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8079371 | 0.81 | NPC1 (0.65) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL8086791 | 0.80 | NPC1 (0.51) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL8091906 | 0.79 | NPC1 (0.56) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL13391762 | 0.77 | KMT2A (0.69) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL5180476 | 0.76 | NPC1 (0.64) | ROCK2NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL4227376 | 0.76 | MTNR1B (0.59) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL5180471 | 0.75 | ROCK2 (0.53) | ROCK2NPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8086755 | 0.75 | RAB9A (0.50) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A |
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 |