Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 7/20 | 0.54 |
| ▸ | CTSB | P07858 | 3/20 | 0.54 |
| ▸ | CTSL | P07711 | 2/20 | 0.54 |
| ▸ | CTSS | P25774 | 2/20 | 0.54 |
| ▸ | KYNU | Q16719 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.47 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.47 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7469120 | 0.94 | CTSK (0.59) | CTSKCTSBCTSLCTSSKYNU | |
| SCHEMBL30764688 | 0.94 | CTSK (0.59) | CTSKCTSBCTSLCTSSKYNU | |
| SCHEMBL24103095 | 0.89 | CTSK (0.57) | CTSKCTSBCTSLCTSSCASP1 | |
| SCHEMBL18822633 | 0.86 | ITGB3 (0.57) | CTSKCTSBCTSLCTSSKYNU | |
| SCHEMBL18803800 | 0.86 | ITGB3 (0.57) | CTSKCTSBCTSLCTSSKYNU | |
| SCHEMBL6505256 | 0.86 | SMN1; SMN2 (0.52) | CTSKCTSBCTSLCTSSKYNU | |
| Hydrochloric Acid SCHEMBL28593461 | 0.85 | ITGB3 (0.56) | CTSKCTSBCTSLCTSSKYNU | |
| SCHEMBL3008067 | 0.85 | CTSK (0.53) | CTSKCTSBCTSLCTSSKYNU | |
| Hydrochloric Acid SCHEMBL18788051 | 0.85 | ITGB3 (0.56) | CTSKCTSBCTSLCTSSKYNU | |
| SCHEMBL15649130 | 0.85 | CTSK (0.60) | CTSKCTSBCTSLCTSSCASP1 |
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-117136178-A | SARS-COV-2 Mpro inhibitor compounds | 赫帕雷斯治疗有限公司 | 2023-11-28 | — | — | CN | disclosed |