Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | ACP3 | P15309 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 4/20 | 0.40 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | POLQ | O75417 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1927969 | 0.80 | CNR2 (0.49) | CYP2C19CNR2ACP3PPARGCACNA2D1 | |
| SCHEMBL18077189 | 0.79 | ACP3 (0.38) | CYP2C19CNR2ACP3RAB9APOLB | |
| SCHEMBL17080046 | 0.78 | MEN1 (0.43) | CYP2C19CNR2RAB9AMAOBPOLB | |
| SCHEMBL598579 | 0.78 | CYP2C19 (0.64) | CYP2C19NFKB1POLBCYP1A2TSHR | |
| SCHEMBL29962195 | 0.76 | CYP2C19 (0.62) | CYP2C19ACP3POLBCYP1A2TSHR | |
| SCHEMBL1908317 | 0.76 | CYP2C19 (0.62) | CYP2C19CYP1A2TSHR | |
| SCHEMBL195362 | 0.76 | CNR2 (0.46) | CYP2C19CNR2ACP3PPARGCACNA2D1 | |
| SCHEMBL10952808 | 0.75 | CYP2C19 (0.60) | CYP2C19POLBCYP1A2TSHR | |
| SCHEMBL719784 | 0.75 | CNR2 (0.45) | CYP2C19CNR2ACP3PPARGCACNA2D1 | |
| SCHEMBL12395027 | 0.75 | CYP1A2 (0.46) | CYP2C19CNR2ACP3PPARGCACNA2D1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3116877-A1 | CHEMICAL COMPOUNDS ACTING AS PERK INHIBITORS | Glaxosmithkline Intellectual Property (No. 2) Limited (GB) | 2017-01-18 | — | — | EP | disclosed |
| WO-2015136463-A1 | CHEMICAL COMPOUNDS ACTING AS PERK INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2015-09-17 | — | — | WO | disclosed |
| WO-2015136463-A1 | CHEMICAL COMPOUNDS ACTING AS PERK INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2015-09-17 | — | — | WO | disclosed |