Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6570097 | 0.84 | SIGMAR1 (0.43) | MAPK1ALDH1A1TSHRNPSR1SIGMAR1 | |
| SCHEMBL13725250 | 0.73 | MAPK1 (0.44) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL13724790 | 0.73 | MAPK1 (0.44) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL18022515 | 0.72 | CYP2D6 (0.56) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL14280023 | 0.72 | CYP2D6 (0.56) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL25740923 | 0.72 | CYP2D6 (0.56) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL25740922 | 0.72 | CYP2D6 (0.56) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL12518845 | 0.72 | CYP2D6 (0.56) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL13725245 | 0.70 | OPRL1 (0.46) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD | |
| SCHEMBL13724952 | 0.70 | OPRL1 (0.46) | MAPK1CYP3A4CYP2C19ALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1100503-B1 | NON-IMIDAZOLE ALKYLAMINES AS HISTAMINE H 3?-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS | ILE BIOPROJET SOC CIV (FR) | 2004-09-22 | — | — | EP | claimed |