Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8731671 | 0.82 | TAAR1 (0.42) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL721007 | 0.81 | TAAR1 (0.56) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL27282155 | 0.80 | TAAR1 (0.41) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL2030841 | 0.80 | TAAR1 (0.71) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL28985382 | 0.79 | TAAR1 (0.54) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL2886837 | 0.78 | TAAR1 (0.52) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL28449371 | 0.77 | TAAR1 (0.50) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL11660292 | 0.76 | PTGS1 (0.50) | PTGS1PTGS2TAAR1ADRA2AADRA2B | |
| SCHEMBL7705346 | 0.76 | MEN1 (0.51) | PTGS1PTGS2TAAR1NPC1RAB9A | |
| SCHEMBL6576818 | 0.75 | GFER (0.40) | TAAR1SMN1; SMN2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0407955-A1 | New hetrazepines acting as PAF antagonists, process for their production and their use as drugs | BOEHRINGER INGELHEIM KG (DE) | 1991-01-16 | — | — | EP | disclosed |