Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | LAP3 | P28838 | 4/20 | 0.36 |
| ▸ | ANPEP | P15144 | 3/20 | 0.34 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | METAP1 | P53582 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.31 |
| ▸ | GABBR1 | Q9UBS5 | 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 | |
|---|---|---|---|---|
| SCHEMBL1831551 | 1.00 | CYP2D6 (0.45) | CYP2D6CYP2C9CYP2C19ALOX15LAP3 | |
| SCHEMBL1830996 | 0.83 | CYP2C9 (0.36) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL1831642 | 0.83 | CYP2C9 (0.36) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL8038311 | 0.79 | ALOX15 (0.41) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL14016339 | 0.78 | ALOX15 (0.48) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| Phosphoric Acid SCHEMBL28734810 | 0.78 | SLC7A5 (0.47) | CYP2D6CYP2C9CYP2C19ALOX15LAP3 | |
| Hydrochloric Acid SCHEMBL17005446 | 0.77 | ALOX15 (0.39) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL9003702 | 0.75 | CYP2D6 (0.53) | CYP2D6CYP2C9CYP2C19ALOX15LAP3 | |
| SCHEMBL20640447 | 0.75 | CYP2D6 (0.53) | CYP2D6CYP2C9CYP2C19ALOX15LAP3 | |
| SCHEMBL9003713 | 0.75 | CYP2D6 (0.53) | CYP2D6CYP2C9CYP2C19ALOX15LAP3 |
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-2322514-A1 | Homoglutamic acid and glutamic acid derivatives | Bayer Schering Pharma Aktiengesellschaft (DE) | 2011-05-18 | — | — | EP | claimed |
| EP-2322514-A1 | Homoglutamic acid and glutamic acid derivatives | Bayer Schering Pharma Aktiengesellschaft (DE) | 2011-05-18 | — | — | EP | disclosed |
| EP-2322514-A1 | Homoglutamic acid and glutamic acid derivatives | Bayer Schering Pharma Aktiengesellschaft (DE) | 2011-05-18 | — | — | EP | disclosed |