Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | KDM5A | P29375 | 1/20 | 0.30 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL408946 | 0.80 | NPSR1 (0.40) | CYP1A2CYP2D6 | |
| SCHEMBL301678 | 0.79 | — | — | |
| SCHEMBL18937400 | 0.78 | NAAA (0.50) | CYP1A2CYP2D6MAOAMAOB | |
| Hydrochloric Acid SCHEMBL4790313 | 0.78 | NPSR1 (0.39) | CYP1A2CYP2D6 | |
| Carbimide SCHEMBL8927383 | 0.77 | CYP1A2 (0.54) | CYP1A2CYP2D6 | |
| Ethane SCHEMBL8026831 | 0.77 | CYP1A2 (0.54) | CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL248532 | 0.77 | CYP1A2 (0.54) | CYP1A2CYP2D6 | |
| Ethylamine SCHEMBL28411175 | 0.77 | CYP1A2 (0.53) | CYP1A2CYP2D6 | |
| SCHEMBL18791748 | 0.77 | CYP1A2 (0.70) | CYP1A2CYP2D6 | |
| Ethyl Chloride SCHEMBL19668563 | 0.77 | CYP1A2 (0.53) | CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4919927-A | Using ammonium chloride | SANOFI (FR) | 1990-04-24 | — | — | US | disclosed |