Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4515972 | 0.77 | CES2 (0.41) | CES2CES1HDAC8HDAC6EPHX1 | |
| SCHEMBL4678441 | 0.75 | CES2 (0.37) | NOS2CES2CES1HDAC8HDAC6 | |
| SCHEMBL7303987 | 0.73 | CES2 (0.41) | CES2CES1HDAC8HDAC6EPHX1 | |
| SCHEMBL9238982 | 0.72 | CES2 (0.44) | CES2CES1HDAC8HDAC6EPHX1 | |
| SCHEMBL8386944 | 0.71 | NAAA (0.38) | CES2CES1HDAC8HDAC6EPHX1 | |
| SCHEMBL4679013 | 0.71 | CES2 (0.32) | NOS2CES2CES1 | |
| SCHEMBL7299667 | 0.70 | NAAA (0.46) | CES2CES1EPHX1 | |
| SCHEMBL7312858 | 0.69 | NAAA (0.49) | CES2CES1EPHX1 | |
| SCHEMBL7331382 | 0.69 | CES2 (0.44) | CES2CES1HDAC8HDAC6EPHX1 | |
| SCHEMBL7334716 | 0.69 | CES2 (0.44) | CES2CES1HDAC8HDAC6EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1210335-A1 | AMINOCARBONYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES, METHOD FOR PRODUCING SAME AND THE USE THEREOF AS MEDICAMENTS | Boehringer Ingelheim Pharma KG (DE) | 2002-06-05 | — | — | EP | disclosed |
| WO-2001014342-A1 | AMINOCARBONYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES, METHOD FOR PRODUCING SAME AND THE USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-03-01 | — | — | WO | disclosed |