Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | KHK | P50053 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | USP25 | Q9UHP3 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4099608 | 0.92 | MAOB (0.42) | KHKMAOBHTR6HRH4CHRNB2 | |
| SCHEMBL4089781 | 0.92 | MAOB (0.42) | KHKMAOBHTR6HRH4CHRNB2 | |
| SCHEMBL4084195 | 0.86 | KHK (0.42) | KHKMAOBHTR6HRH4CCNT1 | |
| SCHEMBL4094561 | 0.85 | KHK (0.38) | KHKMAOBHTR6HRH4CCNT1 | |
| SCHEMBL4089257 | 0.83 | KHK (0.42) | KHKMAOBHTR6CHRNB2CHRNA4 | |
| SCHEMBL4090285 | 0.83 | KHK (0.42) | KHKMAOBHTR6CHRNB2CHRNA4 | |
| SCHEMBL4098957 | 0.82 | KHK (0.46) | KHKMAOBHTR6CCNT1CDK9 | |
| SCHEMBL4084191 | 0.82 | PLK1 (0.43) | KHKHTR7CHRNB2CHRNA4 | |
| SCHEMBL4084188 | 0.82 | PLK1 (0.43) | KHKHTR7CHRNB2CHRNA4 | |
| SCHEMBL4088456 | 0.82 | PLK1 (0.43) | KHKHTR7CHRNB2CHRNA4 |
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-1727821-A1 | SUBSTITUTED DIAZABICYCLOHEPTANES AND THEIR USE AS PROTEIN KINASE INHIBITORS | Amgen Inc. (US) | 2006-12-06 | — | — | EP | disclosed |
| WO-2005070934-A1 | SUBSTITUTED DIAZABICYCLOHEPTANES AND THEIR USE AS PROTEIN KINASE INHIBITORS | AMGEN INC. (US) | 2005-08-04 | — | — | WO | disclosed |