Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA7 | P43166 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5593560 | 0.77 | CHRM3 (0.44) | CHRM3SMN1; SMN2TSHRSLC6A3SLC6A2 | |
| SCHEMBL8259644 | 0.77 | CHRM3 (0.44) | CHRM3SLC6A3CA12CA1CA2 | |
| SCHEMBL19549307 | 0.75 | CHRM3 (0.43) | CHRM3TSHRSLC6A3HSD17B10SLC6A2 | |
| SCHEMBL5607056 | 0.75 | NPSR1 (0.46) | NPSR1SMN1; SMN2TSHRSLC6A3CA12 | |
| SCHEMBL11755378 | 0.75 | NPSR1 (0.46) | NPSR1SMN1; SMN2TSHRSLC6A3CA12 | |
| SCHEMBL11755388 | 0.75 | NPSR1 (0.46) | NPSR1SMN1; SMN2TSHRSLC6A3CA12 | |
| SCHEMBL22717377 | 0.71 | CHRM3 (0.43) | CHRM3NPSR1SMN1; SMN2SLC6A3SLC6A2 | |
| SCHEMBL28924631 | 0.71 | CHRM3 (0.43) | CHRM3NPSR1SMN1; SMN2SLC6A3SLC6A2 | |
| SCHEMBL2131145 | 0.70 | SLC6A3 (0.53) | SLC6A3SLC6A2ACHESLC6A4 | |
| SCHEMBL8636289 | 0.70 | SLC6A3 (0.53) | NPSR1SLC6A3SLC6A2ACHESLC6A4 |
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-3156410-A1 | POLYENE MACROLIDE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 2017-04-19 | — | — | EP | disclosed |