Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | REN | P00797 | 7/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8714654 | 0.84 | CYP1A2 (0.34) | — | |
| SCHEMBL8714346 | 0.82 | SLC6A2 (0.34) | SLC6A2SLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL8714319 | 0.80 | ALOX5AP (0.35) | — | |
| SCHEMBL8718081 | 0.79 | PIN1 (0.33) | — | |
| SCHEMBL8715069 | 0.79 | HRH3 (0.35) | SLC6A2SLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL8715359 | 0.77 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL9250610 | 0.77 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL8714475 | 0.77 | HRH3 (0.34) | SLC6A2SLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL8714489 | 0.75 | HRH3 (0.35) | SLC6A2SLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL9244400 | 0.72 | CYP19A1 (0.45) | HRH3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5719291-A | FUNGICIDE | HOFFMANN-LA ROCHE INC. (US) | 1998-02-17 | — | — | US | disclosed |