Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | RBP4 | P02753 | 1/20 | 0.42 |
| ▸ | BCL6 | P41182 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
| ▸ | AKT2 | P31751 | 1/20 | 0.37 |
| ▸ | LDHA | P00338 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6016374 | 1.00 | PTPN11 (0.47) | PTPN11KMT2ALMNARBP4BCL6 | |
| SCHEMBL6016338 | 0.90 | PTPN11 (0.43) | PTPN11RBP4BCL6PDE10A | |
| SCHEMBL6016341 | 0.90 | PTPN11 (0.43) | PTPN11RBP4BCL6PDE10A | |
| SCHEMBL4134620 | 0.86 | PTPN11 (0.44) | PTPN11RBP4BCL6PDE10AHCRTR2 | |
| SCHEMBL4134623 | 0.86 | PTPN11 (0.44) | PTPN11RBP4BCL6PDE10AHCRTR2 | |
| SCHEMBL4129088 | 0.85 | PTPN11 (0.53) | PTPN11KMT2ARBP4BCL6PDE10A | |
| SCHEMBL4129092 | 0.85 | PTPN11 (0.53) | PTPN11KMT2ARBP4BCL6PDE10A | |
| SCHEMBL4126108 | 0.85 | PTPN11 (0.43) | PTPN11RBP4BCL6HCRTR2HCRTR1 | |
| SCHEMBL4126105 | 0.85 | PTPN11 (0.43) | PTPN11RBP4BCL6HCRTR2HCRTR1 | |
| SCHEMBL4112107 | 0.85 | PTPN11 (0.43) | PTPN11KMT2ALMNARBP4BCL6 |
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-1187815-B1 | 4-PHENYL-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2006-02-08 | — | — | EP | disclosed |
| US-6274588-B1 | NEUROKININ OR SUBSTANCE P ANTAGONISTS; CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDES; ANTIDEPRESSANTS, ANXIOLYTIC AGENTS | HOFFMANN-LA ROCHE INC. | 2001-08-14 | — | — | US | disclosed |