Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL8866075 | 0.89 | ALDH1A1 (0.48) | KIF11CYP1A2SMN1; SMN2MAPTKDM4E | |
| Fumaric Acid SCHEMBL8866093 | 0.89 | ALDH1A1 (0.48) | KIF11CYP1A2SMN1; SMN2MAPTKDM4E | |
| SCHEMBL9583586 | 0.81 | KIF11 (0.43) | SLC6A2TAAR1KIF11SMN1; SMN2HTT | |
| SCHEMBL5305755 | 0.79 | LTA4H (0.52) | SLC6A2TAAR1KIF11HTT | |
| SCHEMBL5308325 | 0.78 | KIF11 (0.50) | SLC6A2TAAR1KIF11CYP3A4 | |
| SCHEMBL9582877 | 0.77 | KIF11 (0.41) | KIF11CYP1A2SMN1; SMN2HTTCYP19A1 | |
| Hydrochloric Acid SCHEMBL9582874 | 0.76 | KIF11 (0.40) | KIF11CYP1A2SMN1; SMN2HTTLMNA | |
| SCHEMBL8784546 | 0.76 | ESR1 (0.50) | KIF11CYP1A2CYP1A1CYP1B1SMN1; SMN2 | |
| SCHEMBL855070 | 0.75 | TAAR1 (0.64) | SLC6A2TAAR1KIF11CYP1A2SMN1; SMN2 | |
| SCHEMBL11880044 | 0.75 | SMN1; SMN2 (0.51) | SMN1; SMN2HTTLMNAMAPTKDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5539120-A | Arylalkyl-amines having anticonvulsant and neuroprotective properties | AGENCE SPATIALE EUROPEENNE (FR) | 1996-07-23 | — | — | US | claimed |
| EP-0356035-B1 | Arylkalkyl-amines and -amides having anticonvulsant and neuroprotective properties | ASTRA AB (SE) | 1996-03-13 | — | — | EP | claimed |
| WO-1991011995-A1 | ARYLALKYL-AMINES AND -AMIDES HAVING ANTICONVULSANT AND NEUROPROTECTIVE PROPERTIES | FISONS CORPORATION (US) | 1991-08-22 | — | — | WO | claimed |
| EP-0356035-A2 | Arylkalkyl-amines and -amides having anticonvulsant and neuroprotective properties | Astra Aktiebolag (SE) | 1990-02-28 | — | — | EP | claimed |
| CN-87104753-A | Prepare the new diphenyl Tri N-Propyl Amine derivative and the method for salt thereof | — | 1988-06-15 | — | — | CN | disclosed |