Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.48 |
| ▸ | TACR1 | P25103 | 3/20 | 0.47 |
| ▸ | QRFPR | Q96P65 | 1/20 | 0.47 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.45 |
| ▸ | RCOR1 | Q9UKL0 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL27766499 | 0.96 | QRFPR (0.44) | CTSLTACR1QRFPRACECTSB | |
| SCHEMBL12292738 | 0.94 | ACE (0.51) | CTSLTACR1QRFPRACECTSB | |
| SCHEMBL12294448 | 0.89 | QRFPR (0.46) | CTSLTACR1QRFPRACEMBTPS1 | |
| Trifluoroacetic Acid SCHEMBL27745749 | 0.88 | REN (0.45) | CTSLCTSBCTSSCTSKPOLB | |
| SCHEMBL2367341 | 0.87 | ACE (0.45) | CTSLTACR1ACECTSBCTSS | |
| Trifluoroacetic Acid SCHEMBL27766395 | 0.85 | CTSL (0.45) | CTSLCTSBCTSSCTSKALDH1A1 | |
| SCHEMBL2367014 | 0.85 | QRFPR (0.40) | CTSLTACR1QRFPRACECTSS | |
| SCHEMBL12293334 | 0.84 | CTSB (0.47) | CTSLQRFPRACECTSBCTSS | |
| SCHEMBL18429658 | 0.83 | ACE (0.62) | TACR1ACEMBTPS1POLB | |
| SCHEMBL30516239 | 0.83 | ACE (0.62) | TACR1ACEMBTPS1POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101466729-A | Lysobactin amides | AICURIS GMBH & CO KG (DE) | 2009-06-24 | — | — | CN | disclosed |