Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 11/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 8/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2731196 | 0.84 | PNMT (0.49) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL27034985 | 0.81 | PNMT (0.48) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL31591048 | 0.81 | PNMT (0.48) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL29113503 | 0.79 | PNMT (0.47) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL30612413 | 0.79 | PNMT (0.47) | PNMTADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL7507958 | 0.79 | NPC1 (0.45) | PNMTADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL7516853 | 0.78 | NPC1 (0.46) | PNMTADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL7508533 | 0.77 | ALDH1A1 (0.48) | PNMTADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL29697845 | 0.77 | HTR2C (0.50) | — | |
| Hydrochloric Acid SCHEMBL26597123 | 0.77 | HTR2C (0.50) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0861250-B1 | AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | ASTRAZENECA AB (SE) | 2002-02-13 | — | — | EP | disclosed |
| US-6140322-A | Amidine and isothiourea derivatives as inhibitors of nitric oxide synthase | ASTRA AKTIEBOLAG (SE) | 2000-10-31 | — | — | US | disclosed |
| US-5929085-A | Amidine and isothiourea derivatives, compositions containing them and their use as inhibitors of nitric oxide synthase | ASTRA AKTIEBOLAG (SE) | 1999-07-27 | — | — | US | disclosed |