Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 3/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 4/20 | 0.35 |
| ▸ | HRH1 | P35367 | 2/20 | 0.35 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 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 | |
|---|---|---|---|---|
| SCHEMBL5558707 | 0.80 | SLC6A2 (0.48) | SLC6A4SLC6A2SLC6A3HTR6TACR1 | |
| SCHEMBL3971824 | 0.80 | NOS2 (0.41) | SLC6A4SLC6A2SLC6A3HTR6TACR1 | |
| SCHEMBL4702470 | 0.78 | SLC6A4 (0.48) | SLC6A4SLC6A2SLC6A3HTR6TACR1 | |
| SCHEMBL4701211 | 0.76 | SLC6A4 (0.44) | SLC6A4SLC6A2SLC6A3TACR1SSTR5 | |
| SCHEMBL3973823 | 0.76 | SLC6A4 (0.40) | SLC6A4SLC6A2SLC6A3HTR6TACR1 | |
| SCHEMBL3976469 | 0.76 | SLC6A2 (0.40) | SLC6A4SLC6A2SLC6A3HTR6 | |
| SCHEMBL3971153 | 0.75 | SLC6A4 (0.52) | SLC6A4SLC6A2SLC6A3HTR6TACR1 | |
| SCHEMBL3927956 | 0.75 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3HTR6TACR1 | |
| SCHEMBL3977983 | 0.75 | SSTR5 (0.41) | SLC6A4SLC6A2SLC6A3TACR1SSTR5 | |
| SCHEMBL4701500 | 0.75 | SLC6A2 (0.41) | SLC6A4SLC6A2SLC6A3 |
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-2044054-A2 | PYRIMIDINE AND QUINAZOLINE DERIVATIVES AS MODULATORS OF SOMATOSTATINE RECEPTOR ACTIVITY | F. Hoffmann-Roche AG (CH) | 2009-04-08 | — | — | EP | disclosed |
| WO-2008000692-A2 | PYRIMIDINE AND QUINAZOLINE DERIVATIVES AS MODULATORS OF SOMATOSTATINE RECEPTOR ACTIVITY | F. HOFFMANN-LA ROCHE AG (CH) | 2008-01-03 | — | — | WO | disclosed |