Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.74 |
| ▸ | RAB9A | P51151 | 7/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.74 |
| ▸ | TP53 | P04637 | 4/20 | 0.74 |
| ▸ | MEN1 | O00255 | 4/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.74 |
| ▸ | GAA | P10253 | 1/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.74 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.74 |
| ▸ | HTT | P42858 | 1/20 | 0.68 |
| ▸ | PLAU | P00749 | 2/20 | 0.59 |
| ▸ | PLG | P00747 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | NAMPT | P43490 | 1/20 | 0.53 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL31680508 | 0.89 | NPC1 (0.93) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL4248472 | 0.88 | KMT2A (0.70) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL4248077 | 0.85 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL1918108 | 0.83 | NPC1 (0.81) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL29420092 | 0.83 | NPC1 (0.81) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL12218147 | 0.81 | RAB9A (0.79) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL28187512 | 0.81 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL7296804 | 0.80 | SMN1; SMN2 (0.77) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL12218328 | 0.77 | MEN1 (0.60) | NPC1RAB9ASMN1; SMN2KMT2ATP53 | |
| SCHEMBL5426350 | 0.77 | NPC1 (0.82) | NPC1RAB9ASMN1; SMN2KMT2ATP53 |
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 |