Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | HMOX1 | P09601 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL454620 | 0.86 | TAAR1 (0.39) | TAAR1SLC6A2HTR2ASLC6A4HRH1 | |
| SCHEMBL10644320 | 0.84 | CHRM2 (0.36) | TAAR1SLC6A2HTR2ASLC6A4HRH1 | |
| SCHEMBL10422228 | 0.78 | SLC6A2 (0.35) | TAAR1SLC6A2HTR2ASLC6A4HRH1 | |
| SCHEMBL9874745 | 0.72 | SLC6A4 (0.46) | TAAR1SLC6A2HTR2ASLC6A4HRH1 | |
| SCHEMBL28133360 | 0.71 | KCNH2 (0.42) | TAAR1KDM4EALDH1A1POLBGAA | |
| SCHEMBL11639984 | 0.71 | TAAR1 (0.42) | TAAR1HMOX1 | |
| SCHEMBL30595204 | 0.70 | TAAR1 (0.39) | TAAR1KCNH2 | |
| SCHEMBL9801376 | 0.70 | KCNH2 (0.44) | TAAR1KDM4EALDH1A1POLBGAA | |
| SCHEMBL28176487 | 0.69 | KCNH2 (0.47) | SLC6A2HTR2ASLC6A4SLC6A3KDM4E | |
| SCHEMBL9801448 | 0.68 | MEN1 (0.38) | SLC6A2SLC6A4SLC6A3ALDH1A1KCNH2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4999440-A | Phenylethyloxirane Intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1991-03-12 | — | — | US | claimed |
| US-4999440-A | Phenylethyloxirane Intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1991-03-12 | — | — | US | disclosed |
| EP-0291795-B1 | HYDROXYALKYL TRIAZOLYL DERIVATIVES | BAYER AG (DE) | 1990-12-05 | — | — | EP | disclosed |
| US-4894383-A | Fungicidal hydroxyalkyl-triazolyl derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1990-01-16 | — | — | US | disclosed |
| EP-0291795-A2 | Hydroxyalkyl triazolyl derivatives | BAYER AG (DE) | 1988-11-23 | — | — | EP | disclosed |