Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL752244 | 0.79 | LMNA (0.37) | TDP1LMNASKP2NPC1RAB9A | |
| SCHEMBL754036 | 0.78 | KMT2A (0.43) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL753767 | 0.76 | ACHE (0.44) | LMNAALDH1A1 | |
| SCHEMBL752230 | 0.73 | FDPS (0.50) | TSHR | |
| SCHEMBL753761 | 0.72 | TAAR1 (0.44) | TDP1NPC1RAB9AALDH1A1CA1 | |
| SCHEMBL10629149 | 0.71 | ALDH1A1 (0.41) | LMNASKP2NPC1RAB9AALDH1A1 | |
| SCHEMBL28440687 | 0.71 | ALDH1A1 (0.41) | LMNASKP2NPC1RAB9AALDH1A1 | |
| SCHEMBL21391752 | 0.71 | LMNA (0.43) | TDP1LMNANPC1RAB9AALDH1A1 | |
| SCHEMBL751764 | 0.71 | PLCG1 (0.41) | CA12CA1CA2CA9TSHR | |
| SCHEMBL751657 | 0.69 | CA1 (0.40) | LMNACA12CA1CA2CA9 |
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-2213166-B1 | Biocidal compounds containing 2-methylisothiazolin-3-one and a haloalkylsulfone | THOR GMBH (DE) | 2012-03-21 | — | — | EP | claimed |