Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 8/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | HTR3B | O95264 | 2/20 | 0.32 |
| ▸ | HTR3A | P46098 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.31 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.31 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4569361 | 0.76 | KCNN3 (0.38) | HRH4CNR2SMN1; SMN2ALKHTR1A | |
| SCHEMBL3695712 | 0.75 | HRH4 (0.46) | HRH4HTR6HTR3BHTR3AHRH3 | |
| SCHEMBL3700003 | 0.74 | PIK3CD (0.41) | HRH4CNR2HTR2A | |
| SCHEMBL3700010 | 0.74 | PIK3CD (0.41) | HRH4CNR2HTR2A | |
| SCHEMBL4569360 | 0.74 | PIK3CD (0.51) | HRH4CNR2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4569362 | 0.71 | PIK3CD (0.50) | HRH4CNR2MEN1KMT2A | |
| SCHEMBL16419892 | 0.69 | ACHE (0.33) | HTR2A | |
| SCHEMBL4569356 | 0.67 | PIK3CD (0.41) | HTR2A | |
| SCHEMBL3707240 | 0.67 | FLT3 (0.45) | CNR2MEN1KMT2ASMN1; SMN2CYP1A2 | |
| SCHEMBL20961866 | 0.66 | PIK3CD (0.45) | HTR2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012064973-A2 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INFINITY PHARMACEUTICALS, INC. (US) | 2012-05-18 | — | — | WO | disclosed |