Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NOS3 | P29474 | 2/20 | 0.41 |
| ▸ | NOS1 | P29475 | 2/20 | 0.41 |
| ▸ | NOS2 | P35228 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 3/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7019552 | 0.84 | PRMT6 (0.39) | ALDH1A1NOS3NOS1NOS2SMN1; SMN2 | |
| SCHEMBL7019556 | 0.84 | PRMT6 (0.39) | ALDH1A1NOS3NOS1NOS2SMN1; SMN2 | |
| SCHEMBL15540612 | 0.78 | SLC9A1 (0.71) | SLC9A1ALDH1A1 | |
| SCHEMBL4134867 | 0.78 | KDM1A (0.59) | SLC9A1ALDH1A1KDM1A | |
| SCHEMBL4133997 | 0.78 | HTR2A (0.51) | SLC9A1ALDH1A1 | |
| SCHEMBL24737580 | 0.78 | SLC9A1 (0.71) | SLC9A1ALDH1A1 | |
| SCHEMBL4133995 | 0.78 | HTR2A (0.51) | SLC9A1ALDH1A1 | |
| SCHEMBL24737578 | 0.78 | SLC9A1 (0.71) | SLC9A1ALDH1A1 | |
| SCHEMBL24737867 | 0.78 | SLC9A1 (0.71) | SLC9A1ALDH1A1 | |
| SCHEMBL4134864 | 0.78 | KDM1A (0.59) | SLC9A1ALDH1A1KDM1A |
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-1368341-A1 | PHENYL DERIVATIVES 3 | MERCK PATENT GmbH (DE) | 2003-12-10 | — | — | EP | disclosed |
| WO-2002074765-A1 | PHENYL DERIVATIVES 3 | MERCK PATENT GMBH (DE) | 2002-09-26 | — | — | WO | disclosed |