Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18601796 | 0.93 | OPRL1 (0.40) | CCR5OPRL1 | |
| SCHEMBL319062 | 0.85 | OPRL1 (0.42) | CYP3A4CYP2D6MEN1MAPK1KMT2A | |
| SCHEMBL318109 | 0.80 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP2C9NFKB1THPO | |
| SCHEMBL318382 | 0.79 | MEN1 (0.42) | CYP3A4CYP2D6MEN1MAPK1KMT2A | |
| SCHEMBL319212 | 0.78 | OPRL1 (0.42) | CYP3A4CYP2D6MEN1MAPK1KMT2A | |
| SCHEMBL318814 | 0.75 | MEN1 (0.48) | CYP3A4CYP2D6MEN1MAPK1KMT2A | |
| SCHEMBL319039 | 0.75 | MEN1 (0.45) | CYP3A4CYP2D6MEN1MAPK1KMT2A | |
| SCHEMBL319185 | 0.74 | MEN1 (0.43) | CYP3A4CYP2D6MEN1MAPK1KMT2A | |
| SCHEMBL319835 | 0.74 | MEN1 (0.51) | CYP3A4CYP2D6CYP2C9MEN1MAPK1 | |
| SCHEMBL318809 | 0.73 | MEN1 (0.44) | CYP3A4CYP2D6MEN1MAPK1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3138841-A1 | D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE | Altos Therapeutics, LLC (US) | 2017-03-08 | — | — | EP | disclosed |