Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 10/20 | 0.36 |
| ▸ | NOS3 | P29474 | 6/20 | 0.36 |
| ▸ | NOS1 | P29475 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12161257 | 0.84 | NOS2 (0.43) | S1PR2NOS2NOS3NOS1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL18640616 | 0.81 | NOS2 (0.41) | S1PR2NOS2NOS3NOS1CCR1 | |
| SCHEMBL18611531 | 0.80 | NOS2 (0.57) | NOS2NOS3NOS1 | |
| SCHEMBL13729089 | 0.78 | CCR1 (0.32) | CCR1 | |
| SCHEMBL18640608 | 0.78 | S1PR2 (0.37) | S1PR2NOS2NOS3NOS1CCR1 | |
| SCHEMBL667378 | 0.77 | NOS2 (0.44) | S1PR2NOS2NOS3NOS1KDM4E | |
| SCHEMBL10367813 | 0.76 | S1PR2 (0.38) | S1PR2NOS2NOS3NOS1KDM4E | |
| SCHEMBL20072591 | 0.76 | NOS2 (0.57) | S1PR2NOS2NOS3NOS1CCR1 | |
| SCHEMBL1821173 | 0.75 | — | — | |
| SCHEMBL20063090 | 0.75 | NOS2 (0.52) | S1PR2NOS2NOS3NOS1KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0946546-B1 | PYRIDIN-2-YL-METHYLAMINE DERIVATIVES, METHOD OF PREPARING AND APPLICATION AS MEDICINE | PF MEDICAMENT (FR) | 2003-06-25 | — | — | EP | disclosed |
| US-6020345-A | Pyridin-2-yl-methylamine derivatives, method of preparing and application as medicine | PIERRE FABRE MEDICAMENT (FR) | 2000-02-01 | — | — | US | disclosed |
| EP-0946546-A1 | PYRIDIN-2-YL-METHYLAMINE DERIVATIVES, METHOD OF PREPARING AND APPLICATION AS MEDICINE | PIERRE FABRE MEDICAMENT (FR) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998022459-A1 | PYRIDIN-2-YL-METHYLAMINE DERIVATIVES, METHOD OF PREPARING AND APPLICATION AS MEDICINE | PIERRE FABRE MEDICAMENT (FR) | 1998-05-28 | — | — | WO | disclosed |