Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 8/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.37 |
| ▸ | LOX | P28300 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7214068 | 0.89 | ROCK1 (0.48) | ROCK1ROCK2KCNH2CYP1A2CYP2C9 | |
| SCHEMBL6436780 | 0.79 | EGFR (0.44) | ROCK1CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL31595916 | 0.79 | EGFR (0.44) | ROCK1CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7219345 | 0.78 | ALDH1A1 (0.40) | ROCK1CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL1204986 | 0.74 | TRPA1 (0.61) | CYP1A2CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL1093339 | 0.74 | TRPA1 (0.54) | CYP1A2CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL27573350 | 0.72 | ROCK1 (0.42) | ROCK1ROCK2KCNH2CYP1A2CYP2C9 | |
| SCHEMBL6439627 | 0.70 | EGFR (0.44) | CYP1A2CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL31595996 | 0.70 | EGFR (0.44) | CYP1A2CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL7456192 | 0.69 | TDP1 (0.62) | FFAR1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1086099-A4 | SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS | AVENTIS PHARM PROD INC (US) | 2002-01-02 | — | — | EP | disclosed |
| EP-1086099-A1 | SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS | Aventis Pharmaceuticals Products Inc. (US) | 2001-03-28 | — | — | EP | disclosed |
| WO-1999062904-A1 | SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS | AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) | 1999-12-09 | — | — | WO | disclosed |