Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | CDC7 | O00311 | 2/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.44 |
| ▸ | PIM1 | P11309 | 2/20 | 0.44 |
| ▸ | CDK2 | P24941 | 2/20 | 0.44 |
| ▸ | HIPK2 | Q9H2X6 | 2/20 | 0.44 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.42 |
| ▸ | FLT3 | P36888 | 3/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALPL | P05186 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TTK | P33981 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10194704 | 0.88 | GRM4 (0.46) | GRM4CDC7ROCK2MAP4K4PIM1 | |
| SCHEMBL9951736 | 0.88 | GRM4 (0.46) | GRM4CDC7ROCK2MAP4K4PIM1 | |
| Hydrochloric Acid SCHEMBL9952647 | 0.86 | GRM4 (0.45) | GRM4CDC7ROCK2MAP4K4PIM1 | |
| Ammonia Solution, Strong SCHEMBL27926209 | 0.85 | FLT3 (0.56) | GRM4ADORA3CDC7ROCK2MAP4K4 | |
| Hydrochloric Acid SCHEMBL28806324 | 0.84 | FLT3 (0.54) | GRM4ADORA3CDC7ROCK2MAP4K4 | |
| SCHEMBL9951780 | 0.83 | GRM4 (0.45) | GRM4CDC7ROCK2MAP4K4PIM1 | |
| SCHEMBL10195754 | 0.83 | GRM4 (0.49) | GRM4CDC7ROCK2MAP4K4PIM1 | |
| SCHEMBL9951926 | 0.83 | OGT (0.43) | GRM4CDC7ROCK2MAP4K4PIM1 | |
| SCHEMBL10196818 | 0.82 | GRM4 (0.46) | GRM4CDC7ROCK2MAP4K4PIM1 | |
| SCHEMBL9952315 | 0.82 | GRM4 (0.44) | GRM4CDC7ROCK2MAP4K4PIM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2655357-B1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO SA (CH) | 2016-06-22 | — | — | EP | disclosed |