Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 12/20 | 0.45 |
| ▸ | CTSL | P07711 | 9/20 | 0.43 |
| ▸ | FPR2 | P25090 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 4/20 | 0.41 |
| ▸ | MMP1 | P03956 | 3/20 | 0.40 |
| ▸ | MMP2 | P08253 | 3/20 | 0.40 |
| ▸ | MMP3 | P08254 | 3/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6688062 | 0.87 | CTSS (0.40) | CTSSCTSLCHRNB2CHRNB4CHRNA3 | |
| SCHEMBL6688102 | 0.81 | CTSL (0.39) | CTSSCTSLFPR2CTSKMMP1 | |
| SCHEMBL6689460 | 0.80 | MMP3 (0.40) | CTSSCTSLMMP1MMP2MMP3 | |
| SCHEMBL5497651 | 0.80 | CTSS (0.40) | CTSSCTSLCTSK | |
| SCHEMBL6693432 | 0.80 | CTSS (0.41) | CTSSCTSLCTSKMMP1MMP2 | |
| SCHEMBL6696331 | 0.79 | CTSS (0.37) | CTSSCTSL | |
| SCHEMBL6690381 | 0.78 | CTSS (0.46) | CTSSCTSLCTSKMMP1MMP2 | |
| SCHEMBL6697367 | 0.78 | CTSS (0.40) | CTSSCTSLCTSKMMP1MMP2 | |
| SCHEMBL6693574 | 0.77 | CTSS (0.42) | CTSSCTSLCTSKMMP1MMP2 | |
| SCHEMBL6690648 | 0.77 | NMT2 (0.45) | CTSSCTSLCTSKMMP1MMP2 |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |