Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 14/20 | 0.62 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18673215 | 0.85 | AOC3 (0.43) | AOC3MTNR1AMTNR1BACACB | |
| SCHEMBL12781036 | 0.76 | AOC3 (1.00) | AOC3 | |
| SCHEMBL972706 | 0.76 | AOC3 (0.55) | AOC3 | |
| Hydrochloric Acid SCHEMBL974175 | 0.75 | AOC3 (0.54) | AOC3 | |
| SCHEMBL12919415 | 0.74 | AOC3 (0.56) | AOC3 | |
| SCHEMBL974072 | 0.72 | AOC3 (0.51) | AOC3 | |
| SCHEMBL18673198 | 0.72 | MTNR1A (0.42) | AOC3MTNR1AMTNR1BACACB | |
| Hydrochloric Acid SCHEMBL975047 | 0.72 | AOC3 (0.50) | AOC3 | |
| SCHEMBL18673187 | 0.71 | AOC3 (0.45) | AOC3MTNR1AMTNR1BACACB | |
| SCHEMBL18673216 | 0.71 | KDM4E (0.41) | AOC3MTNR1AMTNR1BACACB |
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-9603833-B2 | Benzene or thiophene derivative and use thereof as VAP-1 inhibitor | R-TECH UENO, LTD. (JP) | 2017-03-28 | — | — | US | disclosed |