Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CARM1 | Q86X55 | 1/20 | 0.46 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.46 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CSNK1E | P49674 | 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 | |
|---|---|---|---|---|
| SCHEMBL11402250 | 0.87 | CARM1 (0.49) | CARM1PRMT6PRMT8SIGMAR1SLC6A2 | |
| SCHEMBL8091031 | 0.83 | SIGMAR1 (0.62) | SIGMAR1SLC6A2SLC6A4SLC6A3ADRA1A | |
| SCHEMBL8084436 | 0.80 | SIGMAR1 (0.43) | SIGMAR1SLC6A2SLC6A4SLC6A3ADRA2B | |
| SCHEMBL11117786 | 0.79 | OPRK1 (0.48) | SIGMAR1SLC6A2SLC6A4SLC6A3ADRA2B | |
| Iodide SCHEMBL5092821 | 0.78 | OPRK1 (0.47) | SIGMAR1SLC6A2SLC6A4SLC6A3ADRA2B | |
| Hydrochloric Acid SCHEMBL5092786 | 0.78 | OPRK1 (0.47) | SIGMAR1SLC6A2SLC6A4SLC6A3ADRA2B | |
| Bromide SCHEMBL5092308 | 0.78 | OPRK1 (0.47) | SIGMAR1SLC6A2SLC6A4SLC6A3ADRA2B | |
| SCHEMBL6205912 | 0.74 | OPRK1 (0.47) | CARM1PRMT6PRMT8SIGMAR1SLC6A2 | |
| SCHEMBL29107071 | 0.71 | SIGMAR1 (0.48) | SIGMAR1OPRK1KCNH2CSNK1E | |
| SCHEMBL18085350 | 0.70 | CARM1 (0.44) | CARM1PRMT6PRMT8SIGMAR1SLC6A2 |
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-0041757-A1 | Ethylendiamine derivatives, preparation thereof, pharmaceutical compositions containing same and intermediates for their preparation | Simes S.p.A. (IT) | 1981-12-16 | — | — | EP | disclosed |