Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | WNT3A | P56704 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9800386 | 0.83 | HDAC1 (0.45) | CYP19A1HDAC1HDAC8MAPTMAOA | |
| SCHEMBL1457933 | 0.77 | CYP19A1 (0.48) | CYP19A1POLBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28853829 | 0.76 | PTGS2 (0.53) | CYP19A1HDAC1HDAC8 | |
| SCHEMBL6099420 | 0.75 | NPC1 (0.55) | CYP19A1SLC6A2SLC6A4SLC6A3HDAC1 | |
| SCHEMBL4566612 | 0.73 | CYP19A1 (0.45) | CYP19A1SLC6A2SLC6A4SLC6A3HDAC1 | |
| SCHEMBL14207473 | 0.73 | MAOB (0.50) | MAOAMAOBMMP3ALDH1A1 | |
| SCHEMBL1650349 | 0.73 | CA12 (0.49) | CYP19A1SLC6A2SLC6A4SLC6A3HDAC1 | |
| SCHEMBL9269708 | 0.73 | HDAC1 (0.51) | CYP19A1HDAC1HDAC8ENPP2MAOB | |
| SCHEMBL12384488 | 0.72 | HDAC1 (0.57) | CYP19A1SLC6A2SLC6A4SLC6A3HDAC1 | |
| SCHEMBL1275476 | 0.72 | HDAC1 (0.48) | CYP19A1SLC6A2SLC6A4SLC6A3HTR1A |
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-2008056378-A2 | NOVEL PROCESS FOR THE PREPARATION OF NARATRIPTAN HYDROCHLORIDE | NATCO PHARMA LIMITED (IN) | 2008-05-15 | — | — | WO | disclosed |