Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.57 |
| ▸ | CTSK | P43235 | 1/20 | 0.57 |
| ▸ | RORC | P51449 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | FNTA | P49354 | 1/20 | 0.47 |
| ▸ | FNTB | P49356 | 1/20 | 0.47 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.46 |
| ▸ | TACR1 | P25103 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 2/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8338149 | 0.89 | CTSK (0.66) | CTSSCTSKS1PR3MAPTSCN9A | |
| SCHEMBL31048635 | 0.89 | CTSK (0.66) | CTSSCTSKS1PR3MAPTSCN9A | |
| SCHEMBL4597368 | 0.88 | CTSS (0.59) | CTSSCTSKS1PR3MEN1HTT | |
| SCHEMBL4597362 | 0.88 | CTSS (0.59) | CTSSCTSKS1PR3MEN1HTT | |
| SCHEMBL8336482 | 0.87 | SMN1; SMN2 (0.58) | CTSSCTSKRAB9AS1PR3TACR1 | |
| SCHEMBL8337364 | 0.87 | SMN1; SMN2 (0.58) | CTSSCTSKRAB9AS1PR3TACR1 | |
| SCHEMBL8336006 | 0.87 | CTSS (0.56) | CTSSCTSKS1PR3MAPTKMT2A | |
| SCHEMBL8336332 | 0.86 | CTSS (0.60) | CTSSCTSKFNTAFNTBS1PR3 | |
| SCHEMBL8337402 | 0.85 | CTSS (0.59) | CTSSCTSKS1PR3MAPTMEN1 | |
| SCHEMBL8338474 | 0.85 | CTSS (0.59) | CTSSCTSKRORCRAB9ANPC1 |
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-2004022528-A2 | ARYLGLYCINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORT INHIBITORS | NPS ALLELIX CORP. (CA) | 2004-03-18 | — | — | WO | disclosed |