Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | F10 | P00742 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30201037 | 0.85 | DRD2 (0.54) | MAPK1KDM4ELMNAF10NPC1 | |
| Hydrochloric Acid SCHEMBL8054960 | 0.70 | MAPK1 (0.75) | MAPK1CYP1A2CYP2D6CYP2C19LMNA | |
| SCHEMBL5290036 | 0.70 | HTT (0.55) | MAPK1KDM4EALDH1A1LMNANPC1 | |
| SCHEMBL16673625 | 0.68 | F2 (0.76) | MAPK1CYP1A2CYP2D6CYP2C19KDM4E | |
| 1,3-Diethoxybenzene SCHEMBL1100167 | 0.67 | TP53 (0.71) | MAPK1CYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL7986906 | 0.67 | MAPT (0.54) | MAPK1KDM4EALDH1A1LMNAL3MBTL1 | |
| SCHEMBL30201042 | 0.67 | MTNR1A (0.56) | ALDH1A1LMNAMTNR1AMTNR1BNPC1 | |
| SCHEMBL25182698 | 0.66 | ALDH1A1 (0.57) | MAPK1CYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL9145377 | 0.66 | POLB (0.51) | MAPK1CYP1A2CYP2D6CYP2C19MTNR1A | |
| SCHEMBL8725186 | 0.66 | DRD4 (0.61) | ALDH1A1L3MBTL1MTNR1AMTNR1BNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023028086-A1 | COMBINATIONS OF PERIPHERAL 5-HT2A RECEPTOR ANTAGONISTS AND CENTRAL 5-HT2A RECEPTOR AGONISTS | GILGAMESH PHARMACEUTICALS, INC. (US) | 2023-03-02 | — | — | WO | disclosed |