Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HSD11B1 | P28845 | 6/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5717006 | 0.83 | ALDH1A1 (0.44) | ALDH1A1HSD11B1TRPA1GAALMNA | |
| SCHEMBL5717214 | 0.82 | ALDH1A1 (0.43) | ALDH1A1TRPA1GAAEPHX2MEN1 | |
| SCHEMBL5717229 | 0.82 | ALDH1A1 (0.43) | ALDH1A1TRPA1GAAEPHX2TRPV4 | |
| SCHEMBL5717206 | 0.82 | ALDH1A1 (0.43) | ALDH1A1TRPA1GAAEPHX2TRPV4 | |
| SCHEMBL17959557 | 0.82 | TRPA1 (0.48) | ALDH1A1HSD11B1TRPA1GAAPOLB | |
| SCHEMBL16647602 | 0.82 | TRPA1 (0.48) | ALDH1A1HSD11B1TRPA1GAAPOLB | |
| SCHEMBL7407681 | 0.80 | CYP2C19 (0.56) | ALDH1A1HSD11B1GAALMNAPOLB | |
| SCHEMBL21519710 | 0.80 | CYP2D6 (0.55) | ALDH1A1HSD11B1POLBKMT2AMAPT | |
| SCHEMBL21519713 | 0.80 | CYP2D6 (0.55) | ALDH1A1HSD11B1POLBKMT2AMAPT | |
| SCHEMBL7250447 | 0.74 | CYP2C19 (0.59) | ALDH1A1GAALMNAPOLBMEN1 |
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-1664010-A1 | SULFONAMIDES ANTAGONISING N-TYPE CALCIUM CHANNELS | Vernalis (R&D) Limited (GB) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005068448-A1 | SULFONAMIDES ANTAGONISING N-TYPE CALCIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2005-07-28 | — | — | WO | disclosed |