Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 15/20 | 0.45 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7429035 | 0.99 | CYP1A2 (0.48) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7438651 | 0.90 | CYP1A2 (0.47) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7429152 | 0.88 | CYP1A2 (0.60) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7435530 | 0.88 | CYP1A2 (0.63) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7685015 | 0.87 | CYP1A2 (0.57) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| Hydrochloric Acid SCHEMBL7696612 | 0.86 | CYP1A2 (0.56) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7432412 | 0.85 | CYP1A2 (0.57) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7439324 | 0.83 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7438818 | 0.82 | CYP1A2 (0.53) | CYP1A2CYP2C9CYP2C19CASP1LTA4H | |
| SCHEMBL7440449 | 0.82 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19CASP1TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5710153-A | INTERLEUKIN CONVERTING ENZYME INHIBITORS | ONO PHRAMACEUTICAL CO., LTD. (JP) | 1998-01-20 | — | — | US | claimed |
| EP-0761680-A2 | Tetrazole compounds having Interleukin-1beta converting enzyme inhibitory activity | ONO PHARMACEUTICAL CO., LTD. (JP) | 1997-03-12 | — | — | EP | claimed |