Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | BAD | Q92934 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1649 | 0.89 | CES2 (0.62) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL2136276 | 0.89 | MEN1 (0.48) | CA1CA2NPC1RAB9ALMNA | |
| SCHEMBL8945354 | 0.89 | MEN1 (0.48) | CA1CA2NPC1RAB9ALMNA | |
| Hydrochloric Acid SCHEMBL630595 | 0.86 | CES2 (0.59) | CES2CES1CA1CA2BCL2L1 | |
| Hydrochloric Acid SCHEMBL5076467 | 0.86 | APEX1 (0.48) | CA1CA2NPC1RAB9ALMNA | |
| Bromide SCHEMBL11479941 | 0.86 | MEN1 (0.46) | CA1CA2NPC1RAB9ALMNA | |
| SCHEMBL1913545 | 0.82 | LTA4H (0.59) | CES2CES1CA1CA2HDAC1 | |
| SCHEMBL3830978 | 0.82 | CES2 (0.76) | CES2CES1CA1CA2HDAC1 | |
| Ethylene SCHEMBL27657103 | 0.82 | CES2 (0.54) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL2717519 | 0.82 | BCL2L1 (0.64) | CES2CES1CA1CA2BCL2L1 |
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-1685105-A1 | ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | Addex Pharmaceuticals SA (CH) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005044797-A1 | ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | ADDEX PHARMACEUTICALS SA (CH) | 2005-05-19 | — | — | WO | disclosed |