Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A12 | P48065 | 1/20 | 0.48 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.48 |
| ▸ | GRM4 | Q14833 | 7/20 | 0.45 |
| ▸ | GRM6 | O15303 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | GRM8 | O00222 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.39 |
| ▸ | GRM3 | Q14832 | 4/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 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 | |
|---|---|---|---|---|
| SCHEMBL10293983 | 0.72 | GRM4 (0.39) | SLC6A12SLC6A11GRM4GRM6CYP2C19 | |
| SCHEMBL739697 | 0.69 | SLC6A12 (0.42) | SLC6A12SLC6A11GRM4GRM6CYP2C19 | |
| SCHEMBL11230544 | 0.68 | SLC6A12 (0.38) | SLC6A12SLC6A11GRM4GRM6CYP2C19 | |
| SCHEMBL24059815 | 0.68 | SLC6A12 (0.38) | SLC6A12SLC6A11GRM4GRM6CYP2C19 | |
| SCHEMBL24165561 | 0.66 | SLC6A12 (0.33) | SLC6A12SLC6A11 | |
| SCHEMBL21389179 | 0.65 | GRM4 (0.44) | SLC6A12SLC6A11GRM4GRM6CYP2C19 | |
| SCHEMBL21419962 | 0.65 | SLC6A12 (0.70) | SLC6A12SLC6A11GRM4GRM6CYP2C19 | |
| SCHEMBL31181782 | 0.65 | BTK (0.36) | SLC6A12SLC6A11 | |
| SCHEMBL13319983 | 0.64 | GRM2 (0.53) | SLC6A12SLC6A11GRM4GRM6CYP2C19 | |
| SCHEMBL24198019 | 0.64 | SLC6A12 (0.38) | SLC6A12SLC6A11GRM4GRM6CYP2C19 |
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-2651938-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | Vertex Pharmaceuticals Incorporated (US) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012083122-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICAL INCORPORATED (US) | 2012-06-21 | — | — | WO | disclosed |