Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TET3 | O43151 | 1/20 | 0.33 |
| ▸ | FBXL19 | Q6PCT2 | 1/20 | 0.33 |
| ▸ | CXXC5 | Q7LFL8 | 1/20 | 0.33 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.33 |
| ▸ | CXXC4 | Q9H2H0 | 1/20 | 0.33 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.32 |
| ▸ | CHRNG | P07510 | 2/20 | 0.32 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRND | Q07001 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10594591 | 0.67 | ALDH1A1 (0.37) | SLC6A4SLC6A3ALDH1A1SLC6A2CHRNA1 | |
| SCHEMBL435094 | 0.63 | SLC6A4 (0.44) | SLC6A4SLC6A3KMT2AMAPK1SLC6A2 | |
| SCHEMBL436499 | 0.60 | SLC6A4 (0.46) | SLC6A4SLC6A3MAPK1ALDH1A1SLC6A2 | |
| SCHEMBL27783629 | 0.60 | SLC6A4 (0.47) | SLC6A4SLC6A3KMT2AMAPK1ALDH1A1 | |
| SCHEMBL990597 | 0.60 | SLC6A4 (0.47) | SLC6A4SLC6A3KMT2AMAPK1ALDH1A1 | |
| SCHEMBL2737147 | 0.60 | SLC6A3 (0.50) | SLC6A4SLC6A3SLC6A2DRD2CCR2 | |
| Hydrochloric Acid SCHEMBL29020111 | 0.60 | OPRM1 (0.42) | SLC6A4SLC6A3KMT2AMAPK1SLC6A2 | |
| SCHEMBL16553770 | 0.60 | DRD2 (0.55) | SLC6A4SLC6A3KMT2ATET3FBXL19 | |
| SCHEMBL17807530 | 0.60 | ALDH1A1 (0.41) | SLC6A4SLC6A3ALDH1A1SLC6A2CHRNA1 | |
| SCHEMBL16484876 | 0.59 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0089100-B1 | AZOLYL DERIVATIVES AS FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-05-31 | — | — | EP | disclosed |
| US-4518415-A | PLANT GROWTH REGULATORS, FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-05-21 | — | — | US | disclosed |
| EP-0089100-A2 | Azolyl derivatives as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-09-21 | — | — | EP | disclosed |