Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11508933 | 0.74 | TSHR (0.46) | TSHRPPARDMAPTMAPK1TDP1 | |
| SCHEMBL3985445 | 0.74 | TSHR (0.46) | TSHRPPARDMAPTMAPK1TDP1 | |
| SCHEMBL514688 | 0.71 | — | — | |
| SCHEMBL24384243 | 0.71 | TSHR (0.43) | TSHRPPARDMAPTMAPK1TDP1 | |
| SCHEMBL508153 | 0.69 | TSHR (0.50) | TSHRPPARDMAPTMAPK1TDP1 | |
| SCHEMBL8157090 | 0.69 | TSHR (0.50) | TSHRPPARDMAPTMAPK1TDP1 | |
| SCHEMBL21805451 | 0.68 | CHRM1 (0.54) | TSHRPPARDMAPTMAPK1TDP1 | |
| SCHEMBL9633264 | 0.68 | TSHR (0.55) | TSHRPPARDMAPTMAPK1TDP1 | |
| SCHEMBL559843 | 0.67 | PPARD (0.47) | TSHRPPARDTDP1TP53 | |
| SCHEMBL269385 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0820436-A1 | SUBSTITUTED CYCLOALKENES AND THEIR USE AS MICROBICIDES, ESPECIALLY AS FUNGICIDES | BAYER AG (DE) | 1998-01-28 | — | — | EP | disclosed |
| WO-1996031463-A1 | SUBSTITUTED CYCLOALKENES AND THEIR USE AS MICROBICIDES, ESPECIALLY AS FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-10-10 | — | — | WO | disclosed |