Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | P4HB | P07237 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2661346 | 0.79 | SLC6A4 (0.53) | SLC6A4CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL3704721 | 0.76 | TAAR1 (0.56) | SLC6A4CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL1254034 | 0.76 | TAAR1 (0.56) | SLC6A4CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL16325098 | 0.76 | TAAR1 (0.56) | SLC6A4CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL354059 | 0.76 | SLC6A4 (0.50) | SLC6A4CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL15262580 | 0.75 | CYP3A4 (0.51) | SLC6A4CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL15262576 | 0.75 | CYP3A4 (0.51) | SLC6A4CYP3A4MAPK1CYP1A2CYP2D6 | |
| SCHEMBL1599758 | 0.75 | CYP3A4 (0.54) | CYP3A4MAPK1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7898797 | 0.75 | CYP3A4 (0.54) | CYP3A4MAPK1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL18626121 | 0.75 | CYP3A4 (0.54) | CYP3A4MAPK1CYP1A2CYP2D6CYP2C9 |
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-4147780-A | α-Amino-phosphonous acids for inhibiting bacteria and yeast | CIBA-GEIGY CORPORATION (US) | 1979-04-03 | — | — | US | disclosed |