Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | WDR91 | A4D1P6 | 1/20 | 0.35 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.35 |
| ▸ | CHRNG | P07510 | 2/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | CHRND | Q07001 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9661723 | 0.78 | SLC6A4 (0.40) | SLC6A4SLC6A2SLC6A3CHRNA4LMNA | |
| SCHEMBL9874745 | 0.77 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3CHRNA4HTR2A | |
| Chlorobenzene SCHEMBL10966436 | 0.72 | TSHR (0.39) | SLC6A4SLC6A2SLC6A3CHRNA4ALDH1A1 | |
| SCHEMBL9560749 | 0.71 | MAOA (0.39) | SLC6A4SLC6A2SLC6A3CHRNA4LMNA | |
| SCHEMBL10555551 | 0.70 | PPARA (0.41) | SLC6A4SLC6A2SLC6A3CHRNA4HTR2A | |
| SCHEMBL10758825 | 0.69 | CHRNA1 (0.37) | SLC6A4SLC6A2SLC6A3CHRNA4LMNA | |
| SCHEMBL73498 | 0.67 | SLC6A4 (0.67) | SLC6A4SLC6A2SLC6A3CHRNA4HTR2A | |
| SCHEMBL28848601 | 0.67 | SLC6A4 (0.67) | SLC6A4SLC6A2SLC6A3CHRNA4HTR2A | |
| SCHEMBL10536090 | 0.67 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3CHRNA4HTR2A | |
| SCHEMBL454620 | 0.64 | TAAR1 (0.39) | SLC6A4SLC6A2SLC6A3CHRNA4HTR2A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0090993-B1 | SUBSTITUTED HYDROXYALKYL AZOLES, PROCESS FOR PREPARING THEM AND THEIR USE AS ANTIMYCOTICS | BAYER AG (DE) | 1986-05-07 | — | — | EP | claimed |
| EP-0090993-A2 | Substituted hydroxyalkyl azoles, process for preparing them and their use as antimycotics | BAYER AG (DE) | 1983-10-12 | — | — | EP | claimed |
| US-4879385-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-11-07 | — | — | US | disclosed |
| EP-0111234-B1 | FUNGICIDAL AGENTS, THEIR PREPARATION AND USE | BAYER AG (DE) | 1986-10-08 | — | — | EP | disclosed |
| EP-0090993-B1 | SUBSTITUTED HYDROXYALKYL AZOLES, PROCESS FOR PREPARING THEM AND THEIR USE AS ANTIMYCOTICS | BAYER AG (DE) | 1986-05-07 | — | — | EP | disclosed |
| US-4584308-A | FOR PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 1986-04-22 | — | — | US | disclosed |
| EP-0111234-A2 | Fungicidal agents, their preparation and use | BAYER AG (DE) | 1984-06-20 | — | — | EP | disclosed |
| EP-0090993-A2 | Substituted hydroxyalkyl azoles, process for preparing them and their use as antimycotics | BAYER AG (DE) | 1983-10-12 | — | — | EP | disclosed |