Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4181991 | 0.92 | CYP2D6 (0.50) | CYP1A2CYP3A4MAPTKDM1AMAOA | |
| SCHEMBL2774556 | 0.83 | CYP3A4 (0.63) | CYP1A2CYP3A4MAPTCYP2D6TAAR1 | |
| SCHEMBL9335512 | 0.82 | TAAR1 (0.46) | CYP1A2CYP3A4MAPTKDM1AMAOA | |
| SCHEMBL3820698 | 0.80 | CYP1A2 (0.46) | CYP1A2CYP3A4MAPTKDM1AMAOA | |
| SCHEMBL1174021 | 0.80 | CYP2D6 (0.47) | CYP1A2CYP3A4MAPTKDM1AMAOA | |
| SCHEMBL111534 | 0.80 | TAAR1 (0.52) | CYP1A2CYP3A4MAPTKDM1AMAOA | |
| SCHEMBL8918332 | 0.80 | NPC1 (0.47) | MAPTKDM1AMAOAMAOBCYP2D6 | |
| SCHEMBL30896292 | 0.80 | KDM1A (0.46) | CYP1A2CYP3A4MAPTKDM1AMAOA | |
| SCHEMBL3083264 | 0.80 | PDCD1 (0.50) | CYP3A4KDM1AMAOAMAOBCYP2D6 | |
| SCHEMBL3023636 | 0.77 | TAAR1 (0.49) | CYP1A2CYP3A4MAPTKDM1AMAOA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0394440-B1 | PHENYLCARBOXYLIC ACID DERIVATIVES | OTSUKA PHARMA CO LTD (JP) | 1994-05-11 | — | — | EP | disclosed |
| US-4999378-A | Antilipemic, anticholesterol, antidiabetic, treatment of atherosclerosis and obesity | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1991-03-12 | — | — | US | disclosed |