Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | NPC1 | O15118 | 3/20 | 0.60 |
| ▸ | RAB9A | P51151 | 3/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 9/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.49 |
| ▸ | HRH2 | P25021 | 2/20 | 0.49 |
| ▸ | HRH1 | P35367 | 2/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | HTR1B | P28222 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | HTR1E | P28566 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29806244 | 0.85 | SMN1; SMN2 (0.60) | SMN1; SMN2NPC1RAB9ACYP2C19TMEM97 | |
| SCHEMBL206638 | 0.83 | SMN1; SMN2 (0.73) | SMN1; SMN2NPC1RAB9ACYP2C19HTR2C | |
| SCHEMBL324086 | 0.83 | TMEM97 (0.64) | SMN1; SMN2NPC1RAB9ACYP2C19TMEM97 | |
| SCHEMBL23699234 | 0.81 | TAS1R3 (0.45) | NPC1RAB9ACYP2C19MEN1KMT2A | |
| SCHEMBL8560198 | 0.80 | NPC1 (0.62) | SMN1; SMN2NPC1RAB9ACYP2C19TMEM97 | |
| SCHEMBL8566008 | 0.80 | NPC1 (0.62) | SMN1; SMN2NPC1RAB9ACYP2C19TMEM97 | |
| SCHEMBL7424161 | 0.80 | NPC1 (0.62) | SMN1; SMN2NPC1RAB9ACYP2C19TMEM97 | |
| SCHEMBL23699354 | 0.79 | NAMPT (0.56) | — | |
| SCHEMBL12070966 | 0.79 | SMN1; SMN2 (0.84) | SMN1; SMN2NPC1RAB9ACYP2C19NPSR1 | |
| SCHEMBL103560 | 0.79 | SMN1; SMN2 (0.84) | SMN1; SMN2NPC1RAB9ACYP2C19NPSR1 |
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-3858439-A1 | AMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN | ESTEVE PHARMACEUTICALS, S.A. (ES) | 2021-08-04 | — | — | EP | disclosed |
| EP-3858439-A1 | AMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN | ESTEVE PHARMACEUTICALS, S.A. (ES) | 2021-08-04 | — | — | EP | disclosed |