Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | GHSR | Q92847 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10604732 | 0.86 | GHSR (0.39) | CHRNB2CHRNA5CHRNA7CHRNA4GHSR | |
| SCHEMBL10603185 | 0.85 | GHSR (0.42) | GHSRGRIN1GRIN2BPDE4BPTGDR2 | |
| SCHEMBL10606164 | 0.85 | PTGDR2 (0.41) | CHRNB2CHRNA5CHRNA7CHRNA4NPC1 | |
| SCHEMBL10345640 | 0.74 | MMP1 (0.46) | PDE4BPTGDR2 | |
| SCHEMBL10345848 | 0.74 | PDE4B (0.45) | PDE4BPTGDR2 | |
| SCHEMBL10345670 | 0.74 | MMP1 (0.46) | PDE4BPTGDR2 | |
| SCHEMBL10795695 | 0.73 | HTR2A (0.50) | — | |
| SCHEMBL10606169 | 0.73 | PTGDR2 (0.40) | CHRNB2CHRNA5CHRNA7CHRNA4NPC1 | |
| SCHEMBL10600866 | 0.71 | PTGDR2 (0.44) | PTGDR2 | |
| SCHEMBL24229547 | 0.67 | TMEM97 (0.66) | PTGDR2 |
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-0167204-B1 | METHOD FOR IMPROVING THE ABSORPTION AND EFFECTIVENESS OF A CATECHOLAMINE COMPOUND | SIMES S.p.A. Società Italiana Medicinali e Sintetici (IT) | 1989-09-27 | — | — | EP | disclosed |
| US-4673671-A | CONVERSION TO MONO O-PHOSPHATE ESTER | SIMES SOCIETA ITALIANA MEDICINALI E SINTETICI S.P.A. (IT) | 1987-06-16 | — | — | US | disclosed |