Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19903254 | 0.80 | MAOA (0.34) | MAOAMAOBCYP2A6HRH3 | |
| SCHEMBL19903224 | 0.76 | MAOA (0.32) | MAOAMAOBHRH3 | |
| SCHEMBL20311368 | 0.72 | MAOB (0.38) | MAOAMAOBCYP2A6 | |
| SCHEMBL19903214 | 0.72 | HPGD (0.39) | MAOAMAOBCYP2A6 | |
| SCHEMBL19903237 | 0.71 | HPGD (0.38) | MAOAMAOBCYP2A6 | |
| SCHEMBL19903239 | 0.68 | TSHR (0.37) | MAOAMAOBCYP2A6TSHR | |
| SCHEMBL22643093 | 0.68 | ALDH1A1 (0.47) | MAOAMAOBHRH3TSHR | |
| SCHEMBL20108604 | 0.68 | KDM4E (0.47) | MAOAMAOBCYP2A6 | |
| SCHEMBL20108451 | 0.68 | KMT2A (0.49) | TSHR | |
| SCHEMBL19903234 | 0.67 | PDK1 (0.38) | MAOAHRH3 |
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-2976341-B1 | ACYCLIC CYANOETHYLPYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS | MERCK SHARP & DOHME (US) | 2018-02-28 | — | — | EP | disclosed |