Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24355064 | 0.90 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTPOLBTDP1 | |
| SCHEMBL30211662 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KDM4EMAPTPOLBTDP1 | |
| SCHEMBL6988354 | 0.81 | KDM4E (0.74) | ALDH1A1KDM4EMAPTPOLBTDP1 | |
| SCHEMBL16903450 | 0.81 | KDM4E (0.47) | ALDH1A1KDM4EMAPTPOLBTDP1 | |
| SCHEMBL9831746 | 0.80 | KDM4E (0.48) | ALDH1A1KDM4EMAPTPOLBTDP1 | |
| SCHEMBL30323391 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTPOLBTDP1 | |
| SCHEMBL30211679 | 0.80 | ALDH1A1 (0.43) | ALDH1A1KDM4EMAPTPOLBTDP1 | |
| SCHEMBL184071 | 0.76 | MEN1 (0.56) | ALDH1A1KDM4EMAPTSMN1; SMN2KMT2A | |
| SCHEMBL1622710 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTSMN1; SMN2KMT2A | |
| Hydrochloric Acid SCHEMBL184070 | 0.75 | MEN1 (0.55) | ALDH1A1KDM4EMAPTSMN1; SMN2KMT2A |
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-4153549-A2 | RING DEUTERATED GABOXADOL AND ITS USE FOR THE TREATMENT OF PSYCHIATRIC DISORDERS | Certego Therapeutics Inc. (US) | 2023-03-29 | — | — | EP | disclosed |