Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | AOC2 | O75106 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3836805 | 0.75 | TAAR1 (0.38) | CYP3A4CYP2C19CYP2C9KIF11SLC6A4 | |
| SCHEMBL3836548 | 0.75 | TAAR1 (0.38) | CYP3A4CYP2C19CYP2C9KIF11SLC6A4 | |
| SCHEMBL3836993 | 0.75 | TAAR1 (0.38) | CYP3A4CYP2C19CYP2C9KIF11SLC6A4 | |
| SCHEMBL1710534 | 0.74 | KDM4E (0.34) | GAASLC6A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL3967945 | 0.74 | KDM4E (0.33) | CYP2D6SLC6A4 | |
| SCHEMBL1725084 | 0.74 | GAA (0.38) | CYP3A4CYP2C19GAAKMT2ACA1 | |
| SCHEMBL1710504 | 0.74 | HTR6 (0.44) | CYP3A4CYP2C19GAAKMT2AAOC2 | |
| SCHEMBL3839037 | 0.74 | TAAR1 (0.38) | KIF11SLC6A4 | |
| SCHEMBL1725244 | 0.73 | KDM4E (0.35) | GAASLC6A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL1710521 | 0.73 | SLC6A4 (0.33) | SLC6A4 |
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-2344451-A2 | SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2011-07-20 | — | — | EP | disclosed |
| WO-2010028088-A2 | SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2010-03-11 | — | — | WO | disclosed |