Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | PDE9A | O76083 | 1/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21546946 | 0.95 | CYP1A2 (0.39) | MCHR1ALDH1A3GRIA2GRIA4ALDH1A1 | |
| SCHEMBL21546477 | 0.94 | MCHR1 (0.37) | MCHR1ALDH1A3PDE9APDE1CGRIA2 | |
| SCHEMBL21414129 | 0.94 | PDE9A (0.39) | PTGER4PDE9APDE1CALDH1A1LMNA | |
| SCHEMBL21546728 | 0.93 | ALDH1A1 (0.39) | ALDH1A3PTGER4GRIA2GRIA4ALDH1A1 | |
| SCHEMBL21414267 | 0.93 | MAP4K4 (0.39) | ALDH1A3PTGER4GRIA2GRIA4ALDH1A1 | |
| SCHEMBL21546583 | 0.93 | ALDH1A3 (0.40) | ALDH1A3GRIA2GRIA4ALDH1A1CYP1A2 | |
| SCHEMBL21546744 | 0.93 | MAP4K4 (0.40) | ALDH1A3PTGER4GRIA2GRIA4ALDH1A1 | |
| SCHEMBL22760889 | 0.92 | ALDH1A3 (0.37) | ALDH1A3PTGER4GRIA2GRIA4ALDH1A1 | |
| SCHEMBL21546475 | 0.92 | PTGER4 (0.39) | ALDH1A3PTGER4GRIA2GRIA4ALDH1A1 | |
| SCHEMBL21546785 | 0.91 | MAP4K4 (0.39) | ALDH1A3PTGER4GRIA2GRIA4ALDH1A1 |
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-3478793-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-11-06 | — | — | EP | disclosed |