Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 5/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23896921 | 0.85 | MAOB (0.57) | PTPN1MAOBCYP19A1 | |
| Prenylhydroquinone SCHEMBL7036748 | 0.84 | HTT (0.64) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL8698361 | 0.83 | CA12 (0.50) | TYRHTTMEN1CYP3A4KMT2A | |
| SCHEMBL24805134 | 0.82 | HTT (0.50) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL24804434 | 0.82 | HTT (0.50) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL24805120 | 0.82 | POLB (0.51) | TYRHTTHPGDMEN1CYP1A2 | |
| Broussonin C SCHEMBL29369898 | 0.79 | HTT (0.50) | TYRHTTHPGDMEN1CYP3A4 | |
| Broussonin C SCHEMBL23268429 | 0.79 | HTT (0.50) | TYRHTTHPGDMEN1CYP3A4 | |
| SCHEMBL1906438 | 0.77 | TYR (0.50) | TYRHTTMEN1CYP3A4KMT2A | |
| SCHEMBL3749697 | 0.77 | TYR (0.60) | TYRHTTMEN1CYP3A4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998008837-A1 | PHENYLBUTANOL DERIVATIVES, METHODS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF | FARMACON, INC. (US) | 1998-03-05 | — | — | WO | disclosed |