Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 9/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7451239 | 0.85 | CYP2D6 (0.44) | CYP2D6CHRM1KDM4EGAAALDH1A1 | |
| SCHEMBL7108946 | 0.82 | CHRM1 (0.40) | CHRM1KDM4EGAAALDH1A1MEN1 | |
| SCHEMBL8655841 | 0.80 | HTR1A (0.52) | CHRM1KDM4EGAAALDH1A1MAPT | |
| SCHEMBL8781410 | 0.79 | CHRM1 (0.40) | CYP2D6CHRM1KDM4EGAANFKB1 | |
| SCHEMBL7458164 | 0.78 | CHRM1 (0.44) | CYP2D6CHRM1KDM4ETP53CYP1A2 | |
| SCHEMBL909284 | 0.75 | CYP2C19 (0.53) | CYP2D6ALDH1A1MEN1LMNAKMT2A | |
| SCHEMBL11637533 | 0.75 | CYP2C19 (0.44) | CYP2D6ALDH1A1LMNA | |
| SCHEMBL7830236 | 0.75 | CYP2C19 (0.53) | CYP2D6ALDH1A1MEN1LMNAKMT2A | |
| SCHEMBL8654674 | 0.74 | CYP2C19 (0.36) | CHRM1GAAALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL908468 | 0.73 | CYP2C19 (0.52) | CYP2D6ALDH1A1MEN1LMNAKMT2A |
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-0782574-B1 | BICYCLIC CARBOXAMIDES AS 5-HT1A RECEPTORS LIGANDS | WYETH JOHN & BROTHER LTD (GB) | 2002-03-27 | — | — | EP | disclosed |
| US-5610154-A | ANXIOLYTIC AGENTS | JOHN WYETH & BROTHER, LTD. (GB) | 1997-03-11 | — | — | US | disclosed |