Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.59 |
| ▸ | CTSK | P43235 | 1/20 | 0.59 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KLK7 | P49862 | 2/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.44 |
| ▸ | EP300 | Q09472 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8334410 | 1.00 | CTSS (0.59) | CTSSCTSKS1PR3ALDH1A1SMN1; SMN2 | |
| SCHEMBL31048635 | 0.91 | CTSK (0.66) | CTSSCTSKS1PR3KLK7SCN9A | |
| SCHEMBL8338149 | 0.91 | CTSK (0.66) | CTSSCTSKS1PR3KLK7SCN9A | |
| SCHEMBL8334434 | 0.90 | CTSS (0.59) | CTSSCTSKS1PR3ALDH1A1SMN1; SMN2 | |
| SCHEMBL8336332 | 0.89 | CTSS (0.60) | CTSSCTSKS1PR3ALDH1A1SMN1; SMN2 | |
| SCHEMBL31560139 | 0.88 | CTSS (0.59) | CTSSCTSKS1PR3ALDH1A1SMN1; SMN2 | |
| SCHEMBL8338474 | 0.88 | CTSS (0.59) | CTSSCTSKALDH1A1SMN1; SMN2KLK7 | |
| SCHEMBL29866403 | 0.88 | CTSS (0.59) | CTSSCTSKS1PR3ALDH1A1SMN1; SMN2 | |
| SCHEMBL4597362 | 0.88 | CTSS (0.59) | CTSSCTSKS1PR3KLK7SCN9A | |
| SCHEMBL4597368 | 0.88 | CTSS (0.59) | CTSSCTSKS1PR3KLK7SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004022534-A1 | ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS | NPS ALLELIX CORP. (CA) | 2004-03-18 | — | — | WO | disclosed |
| WO-2004022528-A2 | ARYLGLYCINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORT INHIBITORS | NPS ALLELIX CORP. (CA) | 2004-03-18 | — | — | WO | disclosed |