Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 13/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1430764 | 0.76 | GNAI3 (0.41) | — | |
| SCHEMBL1863283 | 0.75 | ALDH1A1 (0.35) | HTR4 | |
| SCHEMBL1867290 | 0.75 | ALDH1A1 (0.35) | HTR4 | |
| SCHEMBL1700192 | 0.75 | ALDH1A1 (0.35) | HTR4 | |
| SCHEMBL1428056 | 0.75 | CTSS (0.34) | — | |
| SCHEMBL1428096 | 0.72 | KDM1A (0.41) | — | |
| SCHEMBL2276120 | 0.71 | TP53 (0.34) | THRBCYP3A4CYP2D6 | |
| SCHEMBL5314921 | 0.71 | HTR4 (0.48) | TACR2THRBHTR4CYP3A4CYP2D6 | |
| SCHEMBL1692668 | 0.70 | CTSS (0.33) | — | |
| SCHEMBL1118813 | 0.70 | CTSS (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007048643-A1 | NOVEL COMPOUND | GLAXO GROUP LIMITED (GB) | 2007-05-03 | — | — | WO | disclosed |