Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6122435 | 0.83 | SLC6A3 (0.44) | SLC6A3SLC6A4SLC6A2ALDH1A1HTT | |
| Hydrochloric Acid SCHEMBL14775166 | 0.77 | POLB (0.52) | SLC6A3SLC6A4SLC6A2HTR2AHRH1 | |
| SCHEMBL10573183 | 0.76 | HTR2A (0.62) | SLC6A3SLC6A4SLC6A2HTR2AHRH1 | |
| SCHEMBL7761458 | 0.75 | SLC6A3 (0.38) | SLC6A3ALDH1A1HTT | |
| SCHEMBL10990350 | 0.74 | SLC6A3 (0.47) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9734820 | 0.73 | SLC6A4 (0.47) | SLC6A3SLC6A4SLC6A2HTR2AHRH1 | |
| SCHEMBL3827110 | 0.73 | AOC3 (0.44) | SLC6A4SLC6A2HTR2AHRH1ALDH1A1 | |
| SCHEMBL11229227 | 0.73 | CHRM2 (0.46) | SLC6A3SLC6A4SLC6A2HTR2AHRH1 | |
| SCHEMBL6955815 | 0.73 | SLC6A3 (0.41) | SLC6A3SLC6A4SLC6A2ALDH1A1HTT | |
| SCHEMBL30021683 | 0.73 | SLC6A3 (0.46) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5089251-A | AROMATIC DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS | SANOFI (FR) | 1992-02-18 | — | — | US | disclosed |
| US-4916156-A | ANTISEPTIC OR PRESERVATIVES IN PHARMACY, COSMETOLOGY OR FOOD STUFF | SANOFI (FR) | 1990-04-10 | — | — | US | disclosed |