Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.52 |
| ▸ | NOS1 | P29475 | 3/20 | 0.52 |
| ▸ | NOS2 | P35228 | 2/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6967385 | 0.81 | NOS1 (0.77) | NOS3NOS1NOS2 | |
| SCHEMBL7079343 | 0.77 | NOS3 (0.51) | NOS3NOS1NOS2CYP1A2CYP3A4 | |
| SCHEMBL6962084 | 0.76 | GRM4 (0.36) | NOS3NOS1NOS2ADRB2CYP1A2 | |
| SCHEMBL9038083 | 0.76 | NOS3 (0.45) | NOS3NOS1NOS2 | |
| Hydrochloric Acid SCHEMBL6968590 | 0.76 | NOS3 (0.46) | NOS3NOS1NOS2 | |
| SCHEMBL27447143 | 0.75 | NOS3 (0.54) | NOS3NOS1NOS2CYP2C19 | |
| Hydrochloric Acid SCHEMBL9213909 | 0.74 | NOS3 (0.55) | NOS3NOS1NOS2CYP2C19 | |
| Bromide SCHEMBL6966433 | 0.74 | NOS3 (0.53) | NOS3NOS1NOS2CYP2C19 | |
| SCHEMBL9037985 | 0.71 | NOS3 (0.69) | NOS3NOS1NOS2CYP1A2CYP3A4 | |
| SCHEMBL6964313 | 0.71 | NOS1 (0.72) | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0713483-A1 | AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES | Astra Aktiebolag (SE) | 1996-05-29 | — | — | EP | claimed |
| WO-1995005363-A1 | AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES | ASTRA AKTIEBOLAG (SE) | 1995-02-23 | — | — | WO | claimed |
| EP-0713483-B1 | AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES | ASTRAZENECA AB (SE) | 2003-01-15 | — | — | EP | disclosed |
| US-6030985-A | Amidine derivatives with nitric oxide synthetase activities | ASTRA AKTIEBOLAG (SE) | 2000-02-29 | — | — | US | disclosed |
| US-5807885-A | Amidine derivatives with nitric oxide synthetase activities | ASTRA AKTIEBOLAG (SE) | 1998-09-15 | — | — | US | disclosed |
| WO-1995005363-A1 | AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES | ASTRA AKTIEBOLAG (SE) | 1995-02-23 | — | — | WO | disclosed |