Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 5/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.44 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | GALR1 | P47211 | 1/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11201412 | 1.00 | S1PR1 (0.44) | S1PR1NOTUMHAO1KMT2ATDP1 | |
| SCHEMBL11195005 | 0.98 | NOTUM (0.45) | S1PR1NOTUMHAO1KMT2ATDP1 | |
| SCHEMBL4565140 | 0.83 | NOTUM (0.34) | S1PR1NOTUMHAO1KMT2ATDP1 | |
| SCHEMBL11195134 | 0.82 | NOTUM (0.33) | S1PR1NOTUMHAO1 | |
| SCHEMBL13539897 | 0.76 | S1PR1 (0.57) | S1PR1NOTUMKMT2ATDP1HSP90AA1 | |
| SCHEMBL11198885 | 0.76 | SLC6A2 (0.41) | HAO1KMT2ATDP1KDM4EGLA | |
| SCHEMBL11200078 | 0.76 | GCGR (0.37) | KCNH2 | |
| SCHEMBL4943496 | 0.74 | DGAT1 (0.40) | NOTUMDGAT1 | |
| SCHEMBL11196684 | 0.74 | SLC6A2 (0.42) | NOTUMHAO1KMT2AKCNH2 | |
| SCHEMBL11194858 | 0.74 | S1PR4 (0.39) | S1PR1HAO1S1PR5HRH3S1PR4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4381306-A | Hydroxypropyl-triazole compounds, their production and their medicinal use | BAYER AKTIENGESELLSCHAFT (DE) | 1983-04-26 | — | — | US | disclosed |