Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 4/20 | 0.54 |
| ▸ | TACR2 | P21452 | 7/20 | 0.51 |
| ▸ | CTSK | P43235 | 2/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.49 |
| ▸ | CTSL | P07711 | 1/20 | 0.47 |
| ▸ | MME | P08473 | 1/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 1/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.46 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.46 |
| ▸ | PSMB10 | P40306 | 1/20 | 0.46 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7398380 | 0.99 | CTSS (0.53) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL7370652 | 0.93 | TACR2 (0.61) | TACR2PSMB8PSMB9PSMB5PSMB10 | |
| SCHEMBL7446475 | 0.91 | CTSS (0.51) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL7401303 | 0.91 | CTSS (0.50) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL7399324 | 0.89 | CTSS (0.48) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL8193256 | 0.89 | CTSS (0.48) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL7345872 | 0.88 | CTSS (0.55) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL8193049 | 0.88 | CTSS (0.48) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL7337508 | 0.87 | CTSS (0.55) | CTSSTACR2CTSKITGB3ITGA2B | |
| SCHEMBL7337619 | 0.87 | CACNA1B (0.57) | CTSSTACR2CTSKCTSLPSMB8 |
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 |
|---|---|---|---|---|---|---|---|
| US-6117841-A | USED TO TREAT STROKE, CEREBRAL ISCHEMIA, PAIN, HEAD TRAUMA OR EPILEPSY | WARNER-LAMBERT COMPANY (US) | 2000-09-12 | — | — | US | disclosed |
| WO-1998054123-A1 | SUBSTITUTED PEPTIDYLAMINE CALCIUM CHANNEL BLOCKERS | WARNER-LAMBERT COMPANY (US) | 1998-12-03 | — | — | WO | disclosed |