Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | ALDH1A3 | P47895 | 4/20 | 0.36 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13571237 | 0.88 | ALDH1A1 (0.39) | ALDH1A1ARALDH1A3ALDH3A1TSHR | |
| SCHEMBL7117400 | 0.78 | ALDH1A1 (0.42) | ALDH1A1ALDH1A3ALDH3A1TSHRFDPS | |
| SCHEMBL20187006 | 0.77 | KDM4E (0.49) | ALDH1A1ARPDE3BPDE3AHSD17B10 | |
| SCHEMBL13630983 | 0.77 | ALDH1A1 (0.40) | ALDH1A1ALDH1A3ALDH3A1TSHRPDE3B | |
| SCHEMBL14477876 | 0.77 | ALDH1A1 (0.41) | ALDH1A1ALDH1A3ALDH3A1TSHRFDPS | |
| SCHEMBL20183933 | 0.75 | ALDH1A3 (0.42) | ALDH1A1ALDH1A3ALDH3A1TSHRFDPS | |
| SCHEMBL7120865 | 0.75 | ALDH1A1 (0.40) | ALDH1A1ALDH1A3ALDH3A1TSHRFDPS | |
| SCHEMBL27986031 | 0.75 | CNR1 (0.41) | ALDH1A1ARTSHRHSD17B10KDM4E | |
| SCHEMBL18179347 | 0.75 | AR (0.43) | ALDH1A1ARPDE3BPDE3A | |
| SCHEMBL24025599 | 0.75 | ALDH1A1 (0.37) | ALDH1A1TSHREGFRTDP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012152983-A1 | PHENYL- SULFONYL DERIVATIVES AS MEDIATORS OF TRPA1 RECEPTOR ACTIVITY FOR THE TREATMENT OF PAIN | ORION CORPORATION (FI) | 2012-11-15 | — | — | WO | disclosed |
| EP-2520566-A1 | New Pharmaceutical Compounds | Orion Corporation (FI) | 2012-11-07 | — | — | EP | disclosed |