Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 18/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 18/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 18/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7594861 | 0.85 | SLC6A4 (0.64) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL4639001 | 0.76 | HTR2C (0.48) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL6684703 | 0.72 | KDM4E (0.40) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9807138 | 0.71 | PLD1 (0.47) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| Bromide SCHEMBL10498794 | 0.71 | RAD52 (0.45) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1074634 | 0.70 | HTR6 (0.50) | SLC6A2SLC6A4SLC6A3ADRB1 | |
| SCHEMBL24629101 | 0.69 | HTR2C (0.43) | SLC6A2SLC6A4SLC6A3 | |
| Quinazolinone SCHEMBL16144844 | 0.69 | PDPK1 (0.46) | SLC6A2SLC6A4SLC6A3ADRB1 | |
| SCHEMBL28947555 | 0.69 | SLC6A4 (0.61) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL7596203 | 0.69 | SLC6A4 (0.61) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 |
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-5696084-A | Amino-lipopetide antifungal agents | ABBOTT LABORATORIES (US) | 1997-12-09 | — | — | US | claimed |