Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 5/20 | 0.47 |
| ▸ | CA2 | P00918 | 5/20 | 0.47 |
| ▸ | CA12 | O43570 | 4/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | CA4 | P22748 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | CA6 | P23280 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | PTPRF | P10586 | 1/20 | 0.46 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10597552 | 0.76 | LOXL2 (0.55) | LOXL2TSHRIDO1ALDH1A1CYP2C19 | |
| SCHEMBL9474702 | 0.76 | LOXL2 (0.55) | LOXL2TSHRCA1CA2CA9 | |
| SCHEMBL75530 | 0.76 | LOXL2 (0.55) | LOXL2TSHRIDO1ALDH1A1CYP2C19 | |
| SCHEMBL751764 | 0.75 | PLCG1 (0.41) | TSHRCA1CA2CA12CA9 | |
| SCHEMBL6940919 | 0.74 | LOXL2 (0.53) | LOXL2TSHRCA1CA2CA12 | |
| SCHEMBL7303378 | 0.74 | CA2 (0.60) | LOXL2TSHRCA1CA2CA12 | |
| Sulfuric Acid SCHEMBL2003766 | 0.74 | LOXL2 (0.49) | LOXL2TSHRCA1CA2CA12 | |
| SCHEMBL751657 | 0.74 | CA1 (0.40) | LOXL2CA1CA2CA12CA9 | |
| SCHEMBL754036 | 0.74 | KMT2A (0.43) | CA1CA2CA12CA9IDO1 | |
| SCHEMBL28357735 | 0.74 | LOXL2 (0.57) | LOXL2TSHRCA1CA2CA12 |
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 |