Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11920351 | 0.96 | MTNR1A (0.36) | NPC1POLBCASP3RAB9ASENP7 | |
| SCHEMBL21905015 | 0.93 | CYP3A4 (0.38) | NPC1POLBCASP3RAB9ASENP7 | |
| SCHEMBL21163118 | 0.93 | MTNR1A (0.34) | NPC1RAB9AMTNR1AMTNR1B | |
| SCHEMBL22417568 | 0.91 | MTNR1A (0.32) | MTNR1AMTNR1B | |
| SCHEMBL22417644 | 0.89 | MTNR1A (0.31) | MTNR1AMTNR1B | |
| SCHEMBL17213612 | 0.85 | MTNR1A (0.45) | POLBMTNR1AMTNR1B | |
| SCHEMBL11920355 | 0.85 | TSHR (0.35) | — | |
| SCHEMBL22417567 | 0.84 | CYP3A4 (0.38) | NPC1POLBCASP3RAB9ASENP7 | |
| SCHEMBL11920353 | 0.83 | AR (0.41) | POLBMTNR1AMTNR1BAR | |
| SCHEMBL16921181 | 0.82 | TSHR (0.33) | — |
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-2675422-B1 | DENTAL COMPOSITIONS COMPRISING ETHYLENICALLY UNSATURATED ADDITION-FRAGMENTATION AGENT | 3M INNOVATIVE PROPERTIES CO (US) | 2020-09-30 | — | — | EP | disclosed |