Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL753864 | 0.78 | TAAR1 (0.42) | TAAR1ALDH1A1LMNAHPGDCA2 | |
| SCHEMBL753761 | 0.77 | TAAR1 (0.44) | MEN1KMT2ATAAR1ALDH1A1GAA | |
| SCHEMBL753729 | 0.76 | ALDH1A1 (0.46) | KMT2ATAAR1ALDH1A1HPGDTSHR | |
| SCHEMBL15752182 | 0.72 | TAAR1 (0.41) | MEN1KMT2ATAAR1PTGS1PTGS2 | |
| SCHEMBL3167835 | 0.72 | RIPK1 (0.48) | KMT2ATAAR1PTGS1PTGS2ALDH1A1 | |
| SCHEMBL7899861 | 0.71 | FAAH (0.50) | MEN1KMT2ATAAR1PTGS1PTGS2 | |
| SCHEMBL28443237 | 0.70 | TAAR1 (0.46) | KMT2ATAAR1PTGS1PTGS2ALDH1A1 | |
| SCHEMBL776517 | 0.70 | ALDH1A1 (0.50) | MEN1KMT2ATAAR1PTGS1PTGS2 | |
| SCHEMBL1821553 | 0.70 | TAAR1 (0.46) | KMT2ATAAR1PTGS1PTGS2ALDH1A1 | |
| SCHEMBL3638610 | 0.68 | TAAR1 (0.52) | KMT2ATAAR1PTGS1PTGS2ALDH1A1 |
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 |