Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL12444102 | 0.93 | MTNR1A (0.43) | MTNR1AMTNR1BHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL19486158 | 0.89 | HTT (0.39) | HTTSMN1; SMN2ALDH1A1CYP2D6CHEK2 | |
| SCHEMBL12515349 | 0.88 | SMN1; SMN2 (0.41) | HTTSMN1; SMN2ALDH1A1CYP2D6CHEK2 | |
| SCHEMBL10198852 | 0.88 | MTNR1A (0.46) | MTNR1AMTNR1BHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL19445563 | 0.87 | ALDH1A1 (0.41) | MTNR1AMTNR1BALDH1A1F2PRSS1 | |
| SCHEMBL13978360 | 0.85 | SMN1; SMN2 (0.44) | HTTSMN1; SMN2ALDH1A1CYP2D6CHEK2 | |
| SCHEMBL19445605 | 0.85 | SMN1; SMN2 (0.39) | HTTSMN1; SMN2ALDH1A1CYP2D6CHEK2 | |
| SCHEMBL12515465 | 0.84 | MTNR1A (0.43) | MTNR1AMTNR1BHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL19481560 | 0.84 | MTNR1A (0.39) | MTNR1AMTNR1BHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL19445606 | 0.83 | SMN1; SMN2 (0.37) | HTTSMN1; SMN2ALDH1A1CYP2D6CHEK2 |
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-2709619-B1 | COMPOUNDS FOR USE IN TREATMENT OF MUCOSITIS | CELLCEUTIX CORP (US) | 2017-10-11 | — | — | EP | disclosed |