Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 3/20 | 0.54 |
| ▸ | MC5R | P33032 | 2/20 | 0.54 |
| ▸ | MC3R | P41968 | 2/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL610921 | 0.96 | MC4R (0.54) | MC4RMC5RMC3RSIGMAR1MAOA | |
| SCHEMBL132201 | 0.93 | MC4R (0.61) | MC4RMC5RMC3RSIGMAR1MAOA | |
| Hydrochloric Acid SCHEMBL7360106 | 0.91 | MC4R (0.59) | MC4RMC5RMC3RSIGMAR1MAOA | |
| SCHEMBL130904 | 0.91 | MC4R (0.59) | MC4RMC5RMC3RSIGMAR1MAOA | |
| SCHEMBL130385 | 0.89 | MC4R (0.57) | MC4RMC5RMC3RSIGMAR1MAOA | |
| Hydrochloric Acid SCHEMBL17260634 | 0.89 | MC4R (0.57) | MC4RMC5RMC3RSIGMAR1MAOA | |
| SCHEMBL136034 | 0.89 | MC4R (0.57) | MC4RMC5RMC3RSIGMAR1MAOA | |
| Hydrochloric Acid SCHEMBL8424014 | 0.87 | MC4R (0.56) | MC4RMC5RMC3RSIGMAR1MAOA | |
| SCHEMBL30418669 | 0.84 | SIGMAR1 (0.68) | MC4RMC5RSIGMAR1CYP1A2HDAC1 | |
| SCHEMBL3175127 | 0.83 | HSD17B1 (0.47) | MC4RMC5RMC3RSIGMAR1MAOA |
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-8450527-B2 | Amine derivative compounds for treating ophthalmic diseases and disorders | ACUCELA INC. (US) | 2013-05-28 | — | — | US | disclosed |