Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.35 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8794997 | 0.84 | HRH3 (0.41) | ALDH1A1HRH3POLBGAAGPR119 | |
| SCHEMBL19297512 | 0.80 | GPR119 (0.50) | ALDH1A1HTTSMN1; SMN2HRH3KMT2A | |
| SCHEMBL20108320 | 0.77 | CASP3 (0.41) | ALDH1A1KMT2APOLBGPR119FPR2 | |
| SCHEMBL20246540 | 0.76 | RAB9A (0.40) | ALDH1A1HTTSMN1; SMN2HRH3GPR119 | |
| SCHEMBL18065567 | 0.75 | KMT2A (0.57) | ALDH1A1HTTKMT2APOLBMEN1 | |
| SCHEMBL15919657 | 0.75 | NOTUM (0.46) | ALDH1A1HTTSMN1; SMN2HRH3KMT2A | |
| SCHEMBL8617445 | 0.73 | GPR119 (0.44) | ALDH1A1HRH3POLBGPR119 | |
| SCHEMBL18801508 | 0.73 | KMT2A (0.59) | HTTKMT2APOLBMEN1GAA | |
| SCHEMBL25074367 | 0.72 | KMT2A (0.48) | ALDH1A1SMN1; SMN2KMT2AMEN1GPR119 | |
| SCHEMBL30201729 | 0.72 | KMT2A (0.48) | ALDH1A1SMN1; SMN2KMT2AMEN1GPR119 |
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 |