Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 8/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 8/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5720167 | 0.84 | TLR9 (0.35) | TLR9TLR7TLR8DRD2DRD4 | |
| SCHEMBL5720129 | 0.84 | TLR9 (0.35) | TLR9TLR7TLR8TSHRALDH1A1 | |
| SCHEMBL5720269 | 0.84 | DRD2 (0.39) | TLR9TLR7TLR8ALDH1A1DRD2 | |
| SCHEMBL5719999 | 0.84 | CHRM2 (0.45) | TLR9TLR7TLR8JAK2JAK1 | |
| SCHEMBL5720185 | 0.82 | DRD2 (0.34) | TLR9TLR7TLR8ALDH1A1DRD2 | |
| SCHEMBL5720128 | 0.81 | TLR7 (0.44) | TLR9TLR7TLR8JAK2JAK1 | |
| SCHEMBL5720388 | 0.79 | DRD2 (0.40) | TLR9TLR7TLR8JAK2JAK1 | |
| SCHEMBL5720132 | 0.79 | TRPV6 (0.41) | TLR9TLR7TLR8ALDH1A1DRD2 | |
| SCHEMBL5720125 | 0.79 | CHRM1 (0.41) | TLR9TLR7TLR8TSHRALDH1A1 | |
| SCHEMBL5720092 | 0.78 | CHRM1 (0.51) | ALDH1A1DRD2DRD4DRD3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1515722-A4 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | MERCK & CO INC (US) | 2006-06-21 | — | — | EP | claimed |
| EP-1515722-A2 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | Merck & Co., Inc. (US) | 2005-03-23 | — | — | EP | claimed |
| WO-2003105781-A2 | OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION | MERCK & CO., INC. (US) | 2003-12-24 | — | — | WO | claimed |