Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 9/20 | 0.36 |
| ▸ | CTSK | P43235 | 8/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 1/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.33 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8587115 | 0.82 | CTSS (0.37) | CTSSCTSKTACR1ITGB3ITGB1 | |
| SCHEMBL8529631 | 0.82 | CTSS (0.43) | CTSSCTSKTACR1CTSLP2RY2 | |
| SCHEMBL8529636 | 0.82 | CTSS (0.43) | CTSSCTSKTACR1CTSLP2RY2 | |
| SCHEMBL8426516 | 0.78 | ITGB3 (0.44) | CTSSCTSKITGB3ITGB1ITGAV | |
| SCHEMBL8422158 | 0.75 | CTSS (0.45) | CTSSCTSKTACR1CTSLP2RY2 | |
| SCHEMBL8530056 | 0.75 | CTSS (0.45) | CTSSCTSKTACR1CTSLMAPT | |
| SCHEMBL8422157 | 0.75 | CTSS (0.45) | CTSSCTSKTACR1CTSLP2RY2 | |
| SCHEMBL8530060 | 0.75 | CTSS (0.45) | CTSSCTSKTACR1CTSLMAPT | |
| SCHEMBL8425902 | 0.74 | NOS3 (0.39) | MAPT | |
| SCHEMBL8422170 | 0.74 | CTSS (0.45) | CTSSCTSKITGB3ITGB1ITGAV |
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-0705257-B1 | AMINOACID DERIVATIVES AS NO SYNTHASE INHIBITORS | WELLCOME FOUND (GB) | 1998-03-11 | — | — | EP | disclosed |