Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | AGXT | P21549 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL729943 | 0.87 | TSHR (0.66) | ALDH1A1TP53CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL10843348 | 0.85 | IDO1 (0.53) | TAAR1SIGMAR1ALDH1A1TP53CYP3A4 | |
| SCHEMBL7238655 | 0.82 | PKM (0.49) | TAAR1SIGMAR1ALDH1A1TP53TSHR | |
| SCHEMBL27695731 | 0.81 | ALDH1A1 (0.66) | TAAR1SIGMAR1ALDH1A1TP53CYP3A4 | |
| SCHEMBL17230492 | 0.79 | TAAR1 (0.59) | TAAR1SIGMAR1CHRM2CHRM1CHRM3 | |
| SCHEMBL7519513 | 0.78 | MEN1 (0.58) | ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL27926923 | 0.78 | MEN1 (0.58) | ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL2549889 | 0.78 | MEN1 (0.58) | ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL791977 | 0.78 | TAAR1 (0.67) | TAAR1SIGMAR1CHRM2CHRM1CHRM3 | |
| SCHEMBL30416281 | 0.77 | ABCB1 (0.67) | TP53CYP3A4TSHRSMN1; SMN2 |
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-1144408-A1 | SUBSTITUTED 1-(PIERIDIN-4-YL)-3-(ARYL) ISOTHIOUREAS THEIR PREPARATION AND THERAPEUTIC APPLICATION | PIERRE FABRE MEDICAMENT (FR) | 2001-10-17 | — | — | EP | disclosed |
| WO-2000043391-A1 | SUBSTITUTED 1-(PIERIDIN-4-YL)-3-(ARYL) ISOTHIOUREAS THEIR PREPARATION AND THERAPEUTIC APPLICATION | PIERRE FABRE MEDICAMENT (FR) | 2000-07-27 | — | — | WO | disclosed |