Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4705827 | 0.87 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3GRM5SSTR5 | |
| SCHEMBL4705309 | 0.87 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3GRM5SSTR5 | |
| SCHEMBL4705296 | 0.86 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3SSTR5HRH1 | |
| SCHEMBL4701120 | 0.84 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3GRM5SSTR5 | |
| SCHEMBL4701168 | 0.84 | SLC6A4 (0.45) | SLC6A2SLC6A4SLC6A3GRM5KCNH2 | |
| SCHEMBL4222747 | 0.84 | DHFR (0.35) | SLC6A2SLC6A4SLC6A3SSTR5HRH1 | |
| SCHEMBL4706328 | 0.84 | SLC6A4 (0.44) | SLC6A2SLC6A4SLC6A3GRM5SSTR5 | |
| SCHEMBL3931780 | 0.84 | TACR1 (0.35) | SLC6A2SLC6A4SLC6A3SSTR5HRH1 | |
| SCHEMBL4593363 | 0.80 | SSTR5 (0.37) | SLC6A2SLC6A4SLC6A3SSTR5HRH1 | |
| SCHEMBL4593843 | 0.79 | SSTR5 (0.43) | SSTR5HRH1KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2001867-A2 | PYRIMIDINE, QUINAZOLINE, PTERIDINE AND TRIAZINE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007110340-A2 | PYRIMIDINE, QUINAZOLINE, PTERIDINE AND TRIAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2007-10-04 | — | — | WO | disclosed |