Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.53 |
| ▸ | OXTR | P30559 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | GHSR | Q92847 | 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 | |
|---|---|---|---|---|
| SCHEMBL3387892 | 0.92 | OXTR (0.47) | OXTRACHEHRH3KDM4E | |
| SCHEMBL3386876 | 0.89 | MAPK14 (0.54) | MAPK14OXTRCHRM2ACHEHTR4 | |
| SCHEMBL3390449 | 0.81 | MAPK14 (0.57) | MAPK14OXTRCHRM2ACHEHTR4 | |
| SCHEMBL3383896 | 0.80 | OXTR (0.48) | OXTRACHEHRH3MGLLKDM4E | |
| SCHEMBL3388360 | 0.80 | HRH3 (0.43) | MAPK14CHRM2ACHEHTR4HRH3 | |
| SCHEMBL3390881 | 0.79 | MAPK14 (0.59) | MAPK14OXTRCHRM2ACHEHTR4 | |
| SCHEMBL3390069 | 0.78 | HRH3 (0.50) | MAPK14OXTRACHEHRH3KDM4E | |
| SCHEMBL3385999 | 0.78 | HTR6 (0.52) | OXTRHRH3 | |
| SCHEMBL3388425 | 0.77 | HRH3 (0.52) | MAPK14CHRM2HRH3DRD2DRD3 | |
| SCHEMBL3386743 | 0.76 | DRD2 (0.48) | MAPK14OXTRCHRM2HRH3DRD2 |
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-2029534-B1 | 1H-INDOL-5-YL-PIPERAZIN-1-YL-METHANONE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2010-12-22 | — | — | EP | disclosed |