Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | FLT1 | P17948 | 1/20 | 0.38 |
| ▸ | FLT4 | P35916 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23978126 | 0.81 | TDP1 (0.44) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL6113079 | 0.81 | NFE2L2 (0.47) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL286054 | 0.80 | LMNA (0.50) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL31369141 | 0.80 | LMNA (0.50) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL2845035 | 0.79 | TDP1 (0.52) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL6478711 | 0.77 | TDP1 (0.50) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL14471816 | 0.77 | TDP1 (0.50) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL10685097 | 0.77 | TDP1 (0.50) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL6547363 | 0.75 | TDP1 (0.48) | TDP1TP53NFE2L2SMN1; SMN2KMT2A | |
| SCHEMBL9420260 | 0.75 | NFE2L2 (0.55) | TDP1TP53NFE2L2SMN1; SMN2KMT2A |
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 |