Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.45 |
| ▸ | HTR3B | O95264 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | HTR3A | P46098 | 2/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.45 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15054794 | 0.68 | ALDH1A1 (0.43) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL2234299 | 0.67 | HRH3 (0.45) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL9064278 | 0.67 | HRH3 (0.49) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL5664122 | 0.66 | HRH3 (0.71) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL29604668 | 0.66 | HRH3 (0.71) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL30824499 | 0.66 | HRH3 (0.71) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL18355560 | 0.66 | CYP1A2 (0.52) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL2123816 | 0.66 | KDM4E (0.65) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL30023844 | 0.66 | KDM4E (0.65) | KDM4EHRH3ALDH1A1HTR3EHTR3B | |
| SCHEMBL3164215 | 0.65 | ALDH1A1 (0.55) | KDM4EHRH3ALDH1A1HTR3EHTR3B |
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-2010088408-A2 | SUBUNIT SELECTIVE NMDA RECEPTOR ANTAGONISTS FOR THE TREATMENT OF NEUROLOGICAL CONDITIONS | EMORY UNIVERSITY (US) | 2010-08-05 | — | — | WO | disclosed |