Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.42 |
| ▸ | ITGAV | P06756 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.42 |
| ▸ | CCKBR | P32239 | 6/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | PLAUR | Q03405 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | REN | P00797 | 4/20 | 0.38 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.38 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.38 |
| ▸ | PSMB10 | P40306 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9337444 | 1.00 | CTSS (0.44) | CTSSCTSKITGB3ITGB1ITGAV | |
| Iodide SCHEMBL9866746 | 0.94 | CTSS (0.44) | CTSSCTSKITGB3ITGB1ITGAV | |
| Iodide SCHEMBL9866737 | 0.94 | CTSS (0.44) | CTSSCTSKITGB3ITGB1ITGAV | |
| Iodide SCHEMBL9865458 | 0.90 | CTSS (0.44) | CTSSCTSKITGB3ITGB1ITGAV | |
| Iodide SCHEMBL9865455 | 0.90 | CTSS (0.44) | CTSSCTSKITGB3ITGB1ITGAV | |
| SCHEMBL9867667 | 0.90 | CTSS (0.49) | CTSSCTSKITGB3ITGB1ITGAV | |
| SCHEMBL9867660 | 0.90 | CTSS (0.49) | CTSSCTSKITGB3ITGB1ITGAV | |
| SCHEMBL9339303 | 0.89 | ITGB3 (0.48) | CTSSCTSKITGB3ITGB1ITGAV | |
| SCHEMBL9339298 | 0.89 | ITGB3 (0.48) | CTSSCTSKITGB3ITGB1ITGAV | |
| SCHEMBL9866632 | 0.84 | ITGB3 (0.42) | CTSSCTSKITGB3ITGA2BPLAU |
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 |
|---|---|---|---|---|---|---|---|
| US-5039805-A | Novel benzoic and phenylacetic acid derivatives | HOFFMANN-LA ROCHE INC. (US) | 1991-08-13 | — | — | US | disclosed |