Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.46 |
| ▸ | NOS2 | P35228 | 3/20 | 0.46 |
| ▸ | NOS1 | P29475 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20382081 | 0.79 | — | — | |
| SCHEMBL18053335 | 0.78 | NOS3 (0.52) | NOS3NOS2NOS1CYP2A6 | |
| SCHEMBL1713842 | 0.77 | NOS3 (0.50) | NOS3NOS2NOS1CYP2A6 | |
| SCHEMBL20245056 | 0.74 | CSF1R (0.43) | — | |
| SCHEMBL13204736 | 0.74 | NOS3 (0.47) | NOS3NOS2NOS1CYP2A6 | |
| SCHEMBL4877753 | 0.72 | NOS3 (0.54) | NOS3NOS2NOS1CYP2A6 | |
| SCHEMBL31695297 | 0.72 | NOS3 (0.54) | NOS3NOS2NOS1CYP2A6 | |
| SCHEMBL625135 | 0.72 | NOS3 (0.54) | NOS3NOS2NOS1CYP2A6 | |
| SCHEMBL6488811 | 0.71 | MAPT (0.46) | NOS3NOS2NOS1 | |
| SCHEMBL24630011 | 0.69 | GAA (0.30) | — |
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-3851437-A2 | METHODS OF PREPARING 1H-PYRROLO[2,3-B]PYRIDINE DERIVATES | Vertex Pharmaceuticals Incorporated (US) | 2021-07-21 | — | — | EP | disclosed |
| WO-2017133667-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AND USE IN TREATMENT, AMELIORATION OR PREVENTION OF INFLUENZA THEREOF | SAVIRA PHARMACEUTICALS GMBH (AT) | 2017-08-10 | — | — | WO | disclosed |