Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | GAA | P10253 | 7/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | RAD52 | P43351 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7140235 | 0.87 | ALDH1A1 (0.41) | KDM4EALDH1A1GAAROCK2ROCK1 | |
| SCHEMBL8550959 | 0.85 | KDM4E (0.39) | KDM4EALDH1A1GAAROCK2ROCK1 | |
| SCHEMBL8706907 | 0.84 | HPGD (0.42) | ROCK2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL8708225 | 0.82 | ROCK1 (0.41) | ROCK2ROCK1KMT2ANPC1RAB9A | |
| SCHEMBL8548044 | 0.81 | CNR1 (0.47) | ROCK2ROCK1RECQLKMT2ANPC1 | |
| SCHEMBL8547927 | 0.80 | ROCK1 (0.37) | KDM4EALDH1A1GAAROCK2ROCK1 | |
| SCHEMBL8547854 | 0.73 | SMN1; SMN2 (0.45) | KDM4EALDH1A1GAAMAPTSMN1; SMN2 | |
| SCHEMBL8181139 | 0.70 | NPC1 (0.48) | ROCK2SMN1; SMN2KMT2ANPC1RAB9A | |
| SCHEMBL8551287 | 0.69 | HPGD (0.42) | ROCK2SMN1; SMN2KMT2ANPC1RAB9A | |
| SCHEMBL7138876 | 0.69 | HTR1F (0.45) | ALDH1A1ROCK2ROCK1MAPTKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998015545-A1 | NEW SEROTONIN 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 1998-04-16 | — | — | WO | disclosed |
| EP-0835869-A2 | New serotonin 5-HT1F agonists | ELI LILLY AND COMPANY (US) | 1998-04-15 | — | — | EP | disclosed |