Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN2A | Q99250 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | PARK7 | Q99497 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11305686 | 0.90 | SCN2A (0.60) | SCN2AGAAMEN1KMT2ACASP6 | |
| SCHEMBL17993459 | 0.87 | SCN2A (0.43) | SCN2AGAAMEN1KMT2ACASP6 | |
| SCHEMBL17993481 | 0.76 | ESR1 (0.48) | SCN2AGAAMEN1KMT2ACASP6 | |
| SCHEMBL10626656 | 0.73 | ESR1 (0.56) | SCN2AGAAMEN1KMT2ACASP6 | |
| SCHEMBL19380369 | 0.71 | IDO1 (0.42) | SCN2AGAAMEN1KMT2ACASP6 | |
| SCHEMBL885606 | 0.71 | SCN2A (0.57) | SCN2AGAAMEN1KMT2ACYP3A4 | |
| SCHEMBL29395615 | 0.71 | SCN2A (0.57) | SCN2AGAAMEN1KMT2ACYP3A4 | |
| SCHEMBL7564128 | 0.70 | AR (0.51) | GAAMEN1KMT2ACASP6ALDH1A1 | |
| SCHEMBL5391799 | 0.70 | CYP3A4 (0.61) | SCN2AMEN1KMT2ACYP3A4NFKB1 | |
| SCHEMBL6680554 | 0.70 | MEN1 (0.71) | GAAMEN1KMT2ACASP6CYP3A4 |
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-3054498-B1 | BISIMIDAZODIAZOCINES | IDEMITSU KOSAN CO (JP) | 2017-09-20 | — | — | EP | disclosed |
| WO-2016125110-A1 | BISIMIDAZOLODIAZOCINES | IDEMITSU KOSAN CO., LTD. (JP) | 2016-08-11 | — | — | WO | disclosed |
| EP-3054498-A1 | Bisimidazodiazocines | Idemitsu Kosan Co., Ltd. (JP) | 2016-08-10 | — | — | EP | disclosed |