Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 4/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL9401303 | 0.86 | CTSA (0.34) | CTSAALDH1A1 | |
| SCHEMBL9401207 | 0.85 | NPC1 (0.34) | CTSAALDH1A1 | |
| SCHEMBL9401279 | 0.85 | NPSR1 (0.37) | CTSA | |
| SCHEMBL9401531 | 0.85 | EDNRB (0.37) | CTSAALDH1A1 | |
| SCHEMBL9401364 | 0.83 | CTSA (0.41) | CTSAESR1 | |
| SCHEMBL9401440 | 0.82 | PTGES (0.40) | — | |
| SCHEMBL9572237 | 0.78 | EDNRB (0.36) | ALDH1A1 | |
| SCHEMBL9401323 | 0.77 | EDNRB (0.37) | — | |
| SCHEMBL9401347 | 0.77 | MEN1 (0.39) | — | |
| SCHEMBL9401325 | 0.76 | HTT (0.36) | CTSAALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5346880-A | Pre- and postemergence | NIHON BAYER AGROCHEM K.K. (JP) | 1994-09-13 | — | — | US | disclosed |
| EP-0565951-A1 | Herbicidally active pyrimidinylthioalkane derivatives | NIHON BAYER AGROCHEM K.K. (JP) | 1993-10-20 | — | — | EP | disclosed |