Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8958091 | 0.79 | TDP1 (0.32) | TDP1FFAR3ALDH1A1 | |
| SCHEMBL10871210 | 0.76 | P2RX4 (0.33) | ALDH1A1 | |
| SCHEMBL4146905 | 0.72 | ALDH1A1 (0.37) | TDP1FFAR3ALDH1A1 | |
| SCHEMBL584108 | 0.69 | TP53 (0.35) | — | |
| SCHEMBL8958094 | 0.69 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL1629285 | 0.67 | CES2 (0.35) | FFAR3ALDH1A1 | |
| SCHEMBL7078801 | 0.67 | ALOX5 (0.34) | TDP1 | |
| SCHEMBL8958069 | 0.67 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL24117676 | 0.65 | SLC7A5 (0.32) | — | |
| SCHEMBL156098 | 0.65 | TDP1 (0.36) | TDP1ALDH1A1 |
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-1620389-A1 | HALOGEN SUBSTITUTED 3,3-DIPHENYLPROPYLAMINES (TOLTERODINE) HAVING ANTIMUSCARINIC ACTIVITY | Pharmacia & Upjohn Company LLC (US) | 2006-02-01 | — | — | EP | disclosed |
| WO-2004096751-A1 | HALOGEN SUBSTITUTED 3,3-DIPHENYLPROPYLAMINES (TOLTERODINE) HAVING ANTIMUSCARINIC ACTIVITY | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-11-11 | — | — | WO | disclosed |