Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.56 |
| ▸ | HPGD | P15428 | 6/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.51 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.51 |
| ▸ | TUBB | P07437 | 1/20 | 0.51 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.51 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL27886632 | 0.86 | KDM4E (0.58) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| SCHEMBL7333773 | 0.84 | KDM4E (0.55) | ALDH1A1KDM4EHPGDMAPTMEN1 | |
| SCHEMBL6739125 | 0.81 | KDM4E (0.58) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| SCHEMBL5780732 | 0.79 | KDM4E (0.56) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| SCHEMBL5622542 | 0.79 | KDM4E (0.56) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| SCHEMBL7954222 | 0.79 | ALOX15 (0.57) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| SCHEMBL1244981 | 0.79 | LMNA (0.49) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| SCHEMBL6804626 | 0.78 | SRD5A2 (0.55) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| SCHEMBL6518295 | 0.77 | KDM4E (0.64) | ALDH1A1KDM4EHPGDRAB9AMAPT | |
| Hydrochloric Acid SCHEMBL13684586 | 0.77 | KDM4E (0.55) | ALDH1A1KDM4EHPGDRAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0674620-A1 | TRYPTAMINE ANALOGUES AS 5-HT 1?-LIKE AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-10-04 | — | — | EP | disclosed |
| WO-1994014771-A1 | TRYPTAMINE ANALOGUES AS 5-HT1-LIKE AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-07-07 | — | — | WO | disclosed |