Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 8/20 | 0.44 |
| ▸ | CTSL | P07711 | 6/20 | 0.43 |
| ▸ | REN | P00797 | 1/20 | 0.38 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | HPGDS | O60760 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.36 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.36 |
| ▸ | PADI1 | Q9ULC6 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8337506 | 0.99 | CTSS (0.46) | CTSSCTSLRENCPB2SIGMAR1 | |
| SCHEMBL5523067 | 0.78 | CTSS (0.57) | CTSSCTSLRENSIGMAR1CTSB | |
| SCHEMBL5523065 | 0.77 | CTSS (0.49) | CTSSCTSLRENSIGMAR1CTSB | |
| SCHEMBL13735669 | 0.74 | MMP1 (0.47) | CTSSCTSLCPB2MMP1MMP2 | |
| SCHEMBL6874696 | 0.74 | CPB2 (0.55) | CTSSCTSLCPB2CTSBCTSK | |
| Lithium Ion SCHEMBL5521688 | 0.71 | CTSS (0.48) | CTSSCTSLCPB2CTSBCTSK | |
| SCHEMBL4331063 | 0.71 | HPGDS (0.46) | CTSSCPB2MMP1MMP2MMP3 | |
| SCHEMBL6876245 | 0.69 | CTSS (0.64) | CTSSCTSLCPB2CTSBCTSK | |
| SCHEMBL21101775 | 0.69 | MMP1 (0.44) | CTSSCTSLCPB2MMP1MMP2 | |
| SCHEMBL7297681 | 0.69 | CTSS (0.48) | CTSSCTSLRENCPB2CTSB |
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-2004017911-A2 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-03-04 | — | — | WO | disclosed |