Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28819153 | 1.00 | HTR1A (0.41) | HTR1APARP1PNMT | |
| SCHEMBL28015407 | 0.90 | HTR1A (0.36) | HTR1A | |
| SCHEMBL28014792 | 0.79 | SLC6A9 (0.40) | — | |
| SCHEMBL28014793 | 0.79 | SLC6A9 (0.40) | — | |
| SCHEMBL7793147 | 0.77 | AKR1C3 (0.41) | — | |
| SCHEMBL4181858 | 0.77 | PNMT (0.43) | PARP1PNMT | |
| Hydrochloric Acid SCHEMBL7798727 | 0.76 | AKR1C3 (0.40) | — | |
| SCHEMBL28093498 | 0.76 | TAS1R3 (0.45) | PARP1PNMT | |
| SCHEMBL1514836 | 0.74 | HSD11B1 (0.48) | PARP1 | |
| SCHEMBL1514789 | 0.74 | NOS3 (0.41) | PNMT |
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 |
|---|---|---|---|---|---|---|---|
| CN-102482203-B | Carbocyclic GLYT1 receptor antagonists | HOFFMANN LA ROCHE | 2015-06-03 | — | — | CN | disclosed |