Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.61 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.42 |
| ▸ | GRK2 | P25098 | 1/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | PIK3R5 | Q8WYR1 | 1/20 | 0.37 |
| ▸ | PIK3R3 | Q92569 | 1/20 | 0.37 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.37 |
| ▸ | ACP1 | P24666 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2767159 | 1.00 | HRH3 (0.61) | HRH3MAP2K1GRK2CYP4F2CYP4A11 | |
| SCHEMBL2767161 | 1.00 | HRH3 (0.61) | HRH3MAP2K1GRK2CYP4F2CYP4A11 | |
| Trifluoroacetic Acid SCHEMBL2767748 | 0.97 | HRH3 (0.58) | HRH3MAP2K1GRK2CYP4F2CYP4A11 | |
| SCHEMBL2767960 | 0.87 | HRH3 (0.60) | HRH3 | |
| SCHEMBL2768376 | 0.83 | HRH3 (0.69) | HRH3LRRK2 | |
| SCHEMBL2768880 | 0.83 | HRH3 (0.69) | HRH3LRRK2 | |
| SCHEMBL2769047 | 0.83 | HRH3 (0.63) | HRH3PIK3CDPIK3R2PIK3CAPIK3CB | |
| SCHEMBL2768527 | 0.83 | HRH3 (0.63) | HRH3PIK3CDPIK3R2PIK3CAPIK3CB | |
| SCHEMBL2767936 | 0.82 | HRH3 (0.57) | HRH3PIK3CDPIK3R2PIK3CAPIK3CB | |
| SCHEMBL2767922 | 0.82 | HRH3 (0.57) | HRH3PIK3CDPIK3R2PIK3CAPIK3CB |
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-1960383-A1 | 5-SUBSTITUTED INDOLE-2-CARBOXAMIDE DERIVATIVES | F. Hoffmann-la Roche AG (CH) | 2008-08-27 | — | — | EP | disclosed |
| WO-2007063000-A1 | 5-SUBSTITUTED INDOLE-2-CARBOXAMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2007-06-07 | — | — | WO | disclosed |