Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 9/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 7/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 7/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10759924 | 0.81 | ADAM17 (0.38) | SIGMAR1 | |
| Hydrochloric Acid SCHEMBL30904664 | 0.75 | HTR1A (0.67) | TMEM97SIGMAR1HTR1AADRA1AADRA1D | |
| SCHEMBL11099168 | 0.73 | HTR1A (0.46) | TMEM97SIGMAR1HTR1AADRA1AADRA1D | |
| SCHEMBL11259848 | 0.71 | HTR1A (0.49) | TMEM97SIGMAR1HTR1AADRA1AADRA1D | |
| Hydrochloric Acid SCHEMBL29449197 | 0.70 | HTR1A (0.48) | TMEM97SIGMAR1HTR1AADRA1AADRA1D | |
| SCHEMBL2109364 | 0.65 | HTR1A (0.39) | HTR1AADRA1AADRA1DADRA1B | |
| Iodide SCHEMBL663030 | 0.64 | HTR1A (0.38) | HTR1AADRA1AADRA1DADRA1B | |
| SCHEMBL12132845 | 0.64 | GRIN1 (0.37) | HTR1AADRA1AADRA1DADRA1B | |
| SCHEMBL12132801 | 0.64 | GRIN1 (0.37) | HTR1AADRA1AADRA1DADRA1B | |
| SCHEMBL12132844 | 0.64 | GRIN1 (0.37) | HTR1AADRA1AADRA1DADRA1B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0097822-B1 | AMINOMETHYLDIOXOLANES AS PARASITICIDES | BAYER AG (DE) | 1987-07-15 | — | — | EP | disclosed |
| US-4668700-A | AMINO KETALS, FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1987-05-26 | — | — | US | disclosed |
| US-4503059-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1985-03-05 | — | — | US | disclosed |
| EP-0097822-A1 | Aminomethyldioxolanes as parasiticides | BAYER AG (DE) | 1984-01-11 | — | — | EP | disclosed |