Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB2 | P05107 | 1/20 | 0.66 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.66 |
| ▸ | ITGAL | P20701 | 1/20 | 0.66 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.62 |
| ▸ | ACE | P12821 | 2/20 | 0.61 |
| ▸ | PLAU | P00749 | 1/20 | 0.61 |
| ▸ | PLAUR | Q03405 | 1/20 | 0.61 |
| ▸ | MME | P08473 | 1/20 | 0.59 |
| ▸ | LTA4H | P09960 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL16617908 | 0.90 | CTSL (0.67) | ITGB2ICAM1ITGALERAP2ACE | |
| SCHEMBL16617905 | 0.90 | CTSL (0.67) | ITGB2ICAM1ITGALERAP2ACE | |
| SCHEMBL8724358 | 0.89 | TACR1 (0.70) | ITGB2ICAM1ITGALERAP2ACE | |
| SCHEMBL8724361 | 0.89 | TACR1 (0.70) | ITGB2ICAM1ITGALERAP2ACE | |
| SCHEMBL30443361 | 0.86 | ITGB2 (0.58) | ITGB2ICAM1ITGALERAP2ACE | |
| SCHEMBL24121867 | 0.84 | ACE (0.71) | ITGB2ICAM1ITGALERAP2ACE | |
| SCHEMBL7402984 | 0.84 | ITGB2 (0.76) | ITGB2ICAM1ITGALERAP2ACE | |
| SCHEMBL30011383 | 0.83 | ACE (0.67) | ACEMMELTA4H | |
| SCHEMBL30011140 | 0.83 | ACE (0.67) | ACEMMELTA4H | |
| SCHEMBL30011935 | 0.83 | ACE (0.67) | ACEMMELTA4H |
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-116284216-A | Aromatic dipeptide functionalized sulfhydryl compound and preparation method and application thereof | 华能武汉发电有限责任公司 | 2023-06-23 | — | — | CN | disclosed |