Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.56 |
| ▸ | TTR | P02766 | 3/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.47 |
| ▸ | AHR | P35869 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | GABRP | O00591 | 3/20 | 0.43 |
| ▸ | GABRD | O14764 | 3/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.43 |
| ▸ | GABRA4 | P48169 | 3/20 | 0.43 |
| ▸ | GABRE | P78334 | 3/20 | 0.43 |
| ▸ | GABRA6 | Q16445 | 3/20 | 0.43 |
| ▸ | GABRG1 | Q8N1C3 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1942331 | 0.81 | MAOA (0.59) | PTPN1KDM4EGAAMAPTSMN1; SMN2 | |
| SCHEMBL16527412 | 0.79 | MAOA (0.66) | TTRADORA3AHRCA1CA2 | |
| SCHEMBL4092241 | 0.77 | TTR (0.71) | PTPN1TTRADORA3AHRCA1 | |
| SCHEMBL16527401 | 0.77 | MAOA (0.70) | CA1CA2CA12CA3CA4 | |
| SCHEMBL218740 | 0.76 | MAOA (0.67) | TTRADORA3AHRCA1CA2 | |
| SCHEMBL4696452 | 0.76 | AHR (0.61) | TTRADORA3AHRCA1CA2 | |
| SCHEMBL11594586 | 0.76 | MAOA (0.67) | TTRADORA3AHRCA1CA2 | |
| SCHEMBL5319348 | 0.76 | AHR (0.51) | PTPN1ADORA3AHRGABRPGABRD | |
| SCHEMBL20346623 | 0.73 | AHR (0.53) | TTRADORA3AHRCA1CA2 | |
| SCHEMBL20346636 | 0.73 | ADORA3 (0.52) | PTPN1TTRADORA3AHRCA1 |
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-9657043-B2 | Amine compound and use thereof for medical purposes | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2017-05-23 | — | — | US | disclosed |