Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ICMT | O60725 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.34 |
| ▸ | DRD2 | P14416 | 6/20 | 0.33 |
| ▸ | DRD3 | P35462 | 6/20 | 0.33 |
| ▸ | CFD | P00746 | 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 | |
|---|---|---|---|---|
| SCHEMBL22724157 | 0.84 | DRD3 (0.35) | HTTP2RX7DRD2DRD3 | |
| SCHEMBL4007505 | 0.80 | HTT (0.39) | HTT | |
| SCHEMBL22572506 | 0.77 | — | — | |
| SCHEMBL1992512 | 0.72 | RIPK2 (0.39) | HTT | |
| SCHEMBL30006444 | 0.69 | LGMN (0.38) | ICMTHTTCFD | |
| SCHEMBL25478486 | 0.68 | GABRA1 (0.32) | — | |
| SCHEMBL22723955 | 0.68 | ICMT (0.37) | ICMTHTTDRD2DRD3CFD | |
| SCHEMBL6611651 | 0.67 | MAPT (0.40) | HTT | |
| SCHEMBL24828460 | 0.67 | HPGD (0.39) | HTT | |
| SCHEMBL1719142 | 0.67 | HPGD (0.48) | HTT |
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-3744721-A1 | CONDENSED CYCLIC COMPOUND HAVING DOPAMINE D3 RECEPTOR ANTAGONISM | Shionogi & Co., Ltd (JP) | 2020-12-02 | — | — | EP | disclosed |