Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5388738 | 0.80 | TSHR (0.59) | TSHRTP53CYP2D6RECQLCYP2C19 | |
| SCHEMBL6229562 | 0.80 | TSHR (0.59) | TSHRTP53CYP2D6RECQLCYP2C19 | |
| SCHEMBL6565308 | 0.80 | TSHR (0.59) | TSHRTP53CYP2D6RECQLCYP2C19 | |
| SCHEMBL5374431 | 0.80 | TSHR (0.59) | TSHRTP53CYP2D6RECQLCYP2C19 | |
| SCHEMBL15207355 | 0.79 | TSHR (0.58) | TSHRTP53CYP2D6RECQLCYP2C19 | |
| SCHEMBL15209272 | 0.79 | TSHR (0.58) | TSHRTP53CYP2D6RECQLCYP2C19 | |
| SCHEMBL15208220 | 0.79 | TSHR (0.58) | TSHRTP53CYP2D6RECQLCYP2C19 | |
| SCHEMBL15074109 | 0.77 | TSHR (0.46) | TSHRTP53CYP2D6CYP2C19LMNA | |
| Alcohol SCHEMBL18886336 | 0.77 | TSHR (0.79) | TSHRTP53CYP2D6RECQLLMNA | |
| Methyl Alcohol SCHEMBL29466887 | 0.76 | TSHR (0.92) | TSHRTP53CYP2D6RECQLLMNA |
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-2574188-A1 | NEW PROCESS FOR THE PREPARATION OF ARYL SUBSTITUTED OLEFINIC AMINES | Targacept, Inc. (US) | 2013-04-03 | — | — | EP | disclosed |
| WO-2011146009-A1 | NEW PROCESS FOR THE PREPARATION OF ARYL SUBSTITUTED OLEFINIC AMINES | TARGACEPT INC. (SE) | 2011-11-24 | — | — | WO | disclosed |