Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | USP14 | P54578 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MAT2A | P31153 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.30 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL13660412 | 0.90 | HRH3 (0.40) | HRH3USP14PDE4BPDE4DTMEM97 | |
| SCHEMBL13660309 | 0.86 | PDE4B (0.43) | HRH3USP14PDE4BPDE4D | |
| SCHEMBL13660463 | 0.86 | PDE4B (0.37) | HRH3USP14PDE4BPDE4DPOLB | |
| SCHEMBL3174423 | 0.82 | PDE4B (0.36) | HRH3USP14PDE4BPDE4DCHRNB2 | |
| SCHEMBL3174425 | 0.82 | PDE4B (0.36) | HRH3USP14PDE4BPDE4DCHRNB2 | |
| SCHEMBL13660308 | 0.80 | CHRNB2 (0.31) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL13660416 | 0.76 | HRH3 (0.42) | HRH3USP14PDE4BPDE4DPOLB | |
| SCHEMBL13660414 | 0.76 | SMN1; SMN2 (0.34) | PDE4BCYP11B2POLBCHRNB2CHRNA4 | |
| SCHEMBL13985504 | 0.75 | CHRNB2 (0.36) | USP14CYP11B2POLBCHRNB2CHRNA4 | |
| SCHEMBL4756478 | 0.75 | CHRNB2 (0.36) | USP14CYP11B2POLBCHRNB2CHRNA4 |
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-2009121036-A2 | SUBSTITUTED ARYL PYRIMIDINONE DERIVATIVES | NEUROGEN CORPORATION (US) | 2009-10-01 | — | — | WO | disclosed |