Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 15/20 | 1.00 |
| ▸ | NOS1 | P29475 | 18/20 | 0.65 |
| ▸ | NOS2 | P35228 | 14/20 | 0.65 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.55 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.55 |
| ▸ | HTR1B | P28222 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7827939 | 0.99 | NOS3 (0.98) | NOS3NOS1NOS2 | |
| SCHEMBL7817523 | 0.87 | NOS3 (0.76) | NOS3NOS1NOS2KCNH2 | |
| SCHEMBL7826140 | 0.86 | NOS3 (0.76) | NOS3NOS1NOS2KCNH2 | |
| SCHEMBL7817443 | 0.86 | NOS3 (0.76) | NOS3NOS1NOS2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL7828295 | 0.86 | NOS3 (0.74) | NOS3NOS1NOS2KCNH2 | |
| Hydrochloric Acid SCHEMBL7832875 | 0.85 | NOS3 (0.74) | NOS3NOS1NOS2KCNH2 | |
| SCHEMBL7511366 | 0.85 | NOS3 (0.74) | NOS3NOS1NOS2KCNH2 | |
| SCHEMBL7824443 | 0.85 | NOS3 (0.73) | NOS3NOS1NOS2KCNH2 | |
| Hydrochloric Acid SCHEMBL7510751 | 0.84 | NOS3 (0.72) | NOS3NOS1NOS2KCNH2 | |
| SCHEMBL7482097 | 0.83 | NOS3 (0.71) | NOS3NOS1NOS2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0983266-B1 | novel tetrahydroisoquinolin thiophenecarboximidamides | ASTRAZENECA AB (SE) | 2001-12-12 | — | — | EP | claimed |
| EP-0983266-A1 | COMPOUNDS | Astra Aktiebolag (SE) | 2000-03-08 | — | — | EP | claimed |
| WO-1998050380-A1 | COMPOUNDS | ASTRA AKTIEBOLAG (SE) | 1998-11-12 | — | — | WO | claimed |
| EP-0983266-B1 | novel tetrahydroisoquinolin thiophenecarboximidamides | ASTRAZENECA AB (SE) | 2001-12-12 | — | — | EP | disclosed |
| US-6166030-A | Compounds | ASTRA AKTIEBOLAG (SE) | 2000-12-26 | — | — | US | disclosed |
| EP-0983266-A1 | COMPOUNDS | Astra Aktiebolag (SE) | 2000-03-08 | — | — | EP | disclosed |
| WO-1998050380-A1 | COMPOUNDS | ASTRA AKTIEBOLAG (SE) | 1998-11-12 | — | — | WO | disclosed |