Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.65 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.65 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.52 |
| ▸ | ABL1 | P00519 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | CASP3 | P42574 | 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 | |
|---|---|---|---|---|
| SCHEMBL8180022 | 0.90 | CYP46A1 (0.58) | SLC6A3SLC6A4MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL6698627 | 0.85 | CYP46A1 (0.50) | SLC6A3SLC6A4MAPTNPC1RAB9A | |
| SCHEMBL7249446 | 0.84 | SLC6A3 (0.65) | SLC6A3SLC6A4MAPTNPC1RAB9A | |
| SCHEMBL26573424 | 0.84 | SLC6A4 (0.65) | SLC6A3SLC6A4MAPTNPC1RAB9A | |
| SCHEMBL6776148 | 0.84 | HDAC7 (0.67) | SLC6A3SLC6A4MAPTL3MBTL1CYP46A1 | |
| SCHEMBL2723555 | 0.83 | SLC6A3 (0.63) | SLC6A3SLC6A4MAPTNPC1RAB9A | |
| SCHEMBL13817373 | 0.83 | CYP46A1 (0.56) | SLC6A3SLC6A4MAPTL3MBTL1CYP46A1 | |
| SCHEMBL6489883 | 0.82 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2HDAC7KDM4E | |
| SCHEMBL27310394 | 0.82 | CYP46A1 (0.50) | SLC6A3SLC6A4MAPTNPC1RAB9A | |
| SCHEMBL6642121 | 0.81 | SLC6A3 (0.60) | SLC6A3SLC6A4MAPTNPC1RAB9A |
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-2012059442-A2 | NEUROTRYPSIN INHIBITORS | NEUROTUNE AG (CH) | 2012-05-10 | — | — | WO | disclosed |