Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 3/20 | 0.45 |
| ▸ | PNMT | P11086 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | S100A9 | P06702 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | IGF1R | P08069 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL754038 | 0.76 | PNMT (0.47) | IDO1PNMTTAAR1 | |
| SCHEMBL755591 | 0.73 | TDP1 (0.38) | TSHR | |
| SCHEMBL15231686 | 0.73 | IDO1 (0.54) | FDPSIDO1PNMTTAAR1TSHR | |
| SCHEMBL9421739 | 0.72 | GSTO1 (0.60) | FDPSIDO1PNMTTAAR1TSHR | |
| SCHEMBL27738563 | 0.71 | IDO1 (0.52) | FDPSIDO1PNMTTAAR1TSHR | |
| SCHEMBL74006 | 0.71 | IDO1 (0.52) | FDPSIDO1PNMTTAAR1TSHR | |
| SCHEMBL8372485 | 0.71 | IDO1 (0.52) | FDPSIDO1PNMTTAAR1TSHR | |
| SCHEMBL751764 | 0.71 | PLCG1 (0.41) | IDO1TAAR1TSHR | |
| SCHEMBL31374431 | 0.71 | IDO1 (0.52) | FDPSIDO1PNMTTAAR1TSHR | |
| SCHEMBL751657 | 0.69 | CA1 (0.40) | IDO1TAAR1 |
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 |