Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.46 |
| ▸ | NOS2 | P35228 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | CCR1 | P32246 | 2/20 | 0.37 |
| ▸ | CCR5 | P51681 | 2/20 | 0.37 |
| ▸ | CCR8 | P51685 | 2/20 | 0.37 |
| ▸ | AGBL2 | Q5U5Z8 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.30 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL286660 | 1.00 | NOS3 (0.46) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| Hydrochloric Acid SCHEMBL1193387 | 0.98 | NOS3 (0.45) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| Hydrochloric Acid SCHEMBL29861810 | 0.98 | NOS3 (0.45) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| SCHEMBL873234 | 0.79 | NOS3 (0.48) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| SCHEMBL29384905 | 0.79 | NOS3 (0.48) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| SCHEMBL2112705 | 0.78 | S1PR1 (0.39) | AGBL2L3MBTL1KDM4EMAPK1KMT2A | |
| SCHEMBL16039165 | 0.78 | CCR1 (0.34) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| SCHEMBL29636159 | 0.78 | CCR1 (0.34) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| SCHEMBL13196217 | 0.77 | NOS3 (0.46) | NOS3NOS1NOS2HSP90AA1HSP90AB1 | |
| SCHEMBL17248011 | 0.77 | NOS3 (0.46) | NOS3NOS1NOS2HSP90AA1HSP90AB1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117720518-B | Benzimidazole compound, preparation method thereof, pharmaceutical composition and application | 江苏海洋大学 | 2024-08-13 | — | — | CN | disclosed |
| CN-118159530-A | Compounds for the treatment of pain, in particular neuropathic pain and/or other diseases or disorders associated with AT2R and/or AT2R mediated signalling | 康福治疗有限公司 | 2024-06-07 | — | — | CN | disclosed |
| EP-4377307-A1 | COMPOUNDS FOR THE TREATMENT OF PAIN, IN PARTICULAR NEUROPATHIC PAIN, AND/OR OTHER DISEASES OR DISORDERS THAT ARE ASSOCIATED WITH AT2R AND/OR AT2R MEDIATED SIGNALING | Confo Therapeutics N.V. (BE) | 2024-06-05 | — | — | EP | disclosed |
| CN-117720518-A | Benzimidazole compound, preparation method thereof, pharmaceutical composition and application | 江苏海洋大学 | 2024-03-19 | — | — | CN | disclosed |
| WO-2023006893-A1 | COMPOUNDS FOR THE TREATMENT OF PAIN, IN PARTICULAR NEUROPATHIC PAIN, AND/OR OTHER DISEASES OR DISORDERS THAT ARE ASSOCIATED WITH AT2R AND/OR AT2R MEDIATED SIGNALING | CONFO THERAPEUTICS N.V. (BE) | 2023-02-02 | — | — | WO | disclosed |