Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 4/20 | 0.54 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | ANPEP | P15144 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7442355 | 0.86 | CTSK (0.71) | CTSKCTSS | |
| SCHEMBL7449272 | 0.85 | CTSK (0.52) | CTSKALDH1A1SMN1; SMN2CTSS | |
| SCHEMBL7435956 | 0.81 | CTSK (0.55) | CTSKALDH1A1CTSS | |
| SCHEMBL7441219 | 0.81 | POLB (0.46) | CTSKCACNA1BALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL30687286 | 0.80 | CACNA1B (0.54) | CTSKCACNA1BALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL16908253 | 0.80 | CACNA1B (0.54) | CTSKCACNA1BALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL7433454 | 0.79 | CTSK (0.55) | CTSKCACNA1BCTSS | |
| SCHEMBL3418637 | 0.79 | ALDH1A1 (0.62) | ALDH1A1HTTSMN1; SMN2MMP13POLB | |
| SCHEMBL7440842 | 0.77 | CTSK (0.53) | CTSKALDH1A1SMN1; SMN2MMP13CTSS | |
| SCHEMBL7433368 | 0.77 | RAB9A (0.42) | CTSKCACNA1BALDH1A1SMN1; SMN2POLB |
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-6187905-B1 | PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES | HOFFMANN-LA ROCHE INC. | 2001-02-13 | — | — | US | disclosed |