Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 8/20 | 0.37 |
| ▸ | ERN1 | O75460 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28911180 | 0.95 | PTGDR2 (0.38) | PTGDR2ERN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28542683 | 0.88 | PTGS2 (0.36) | PTGDR2ERN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28539672 | 0.83 | PTGS2 (0.38) | PTGDR2ERN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28549312 | 0.81 | BRD4 (0.47) | PTGDR2ERN1SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL28543014 | 0.81 | LMNA (0.44) | PTGDR2 | |
| SCHEMBL28911175 | 0.77 | SCN9A (0.42) | PTGDR2ERN1SMN1; SMN2PTGS2PTGS1 | |
| SCHEMBL28544660 | 0.76 | LMNA (0.46) | PTGDR2 | |
| SCHEMBL9825441 | 0.70 | SMN1; SMN2 (0.40) | PTGDR2ERN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28064700 | 0.70 | PTGS2 (0.44) | PTGDR2ERN1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL7092074 | 0.70 | SMN1; SMN2 (0.61) | ERN1SMN1; SMN2ALDH1A1MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-105712952-B | 2-substituted oxy-5-methylsulfonyl phenyl piperazine amide analogue and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2021-03-26 | — | — | CN | disclosed |