Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 11/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.41 |
| ▸ | TACR1 | P25103 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.33 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.32 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4704418 | 0.90 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3TACR1KCNH2 | |
| SCHEMBL4700562 | 0.85 | SSTR5 (0.41) | SLC6A2SLC6A4SLC6A3KCNH2SSTR5 | |
| SCHEMBL4703414 | 0.83 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3TACR1KCNH2 | |
| SCHEMBL4702314 | 0.83 | TACR1 (0.41) | SLC6A2SLC6A4SLC6A3TACR1KCNH2 | |
| SCHEMBL4705834 | 0.82 | SLC6A4 (0.41) | SLC6A2SLC6A4SLC6A3TACR1KCNH2 | |
| SCHEMBL4701121 | 0.82 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3TACR1KCNH2 | |
| SCHEMBL4700329 | 0.80 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3TACR1KCNH2 | |
| SCHEMBL4593292 | 0.80 | SSTR5 (0.39) | SLC6A2SLC6A4SLC6A3KCNH2SSTR5 | |
| SCHEMBL4703961 | 0.76 | IKBKB (0.40) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4591213 | 0.75 | TACR1 (0.39) | SLC6A2SLC6A4SLC6A3TACR1KCNH2 |
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 |