Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | S100A4 | P26447 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.42 |
| ▸ | GABRP | O00591 | 1/20 | 0.42 |
| ▸ | GABRD | O14764 | 1/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.42 |
| ▸ | GABRE | P78334 | 1/20 | 0.42 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.42 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16655162 | 0.91 | ESR1 (0.57) | ACHEESR1ESR2LMNAS100A4 | |
| SCHEMBL17993481 | 0.83 | ESR1 (0.48) | ESR1ESR2LMNACA2CA9 | |
| SCHEMBL19380491 | 0.75 | LMNA (0.71) | LMNACA2CA9SCN2AMEN1 | |
| SCHEMBL27420986 | 0.75 | GRIK1 (0.50) | ACHEESR1ESR2LMNAS100A4 | |
| SCHEMBL5707721 | 0.75 | ALDH1A1 (0.45) | ACHEESR1ESR2LMNACA2 | |
| SCHEMBL5846779 | 0.75 | LMNA (0.61) | ESR1ESR2LMNAS100A4CA2 | |
| SCHEMBL17993495 | 0.74 | LMNA (0.45) | ACHEESR1ESR2LMNACA2 | |
| SCHEMBL5707613 | 0.74 | ALDH1A1 (0.54) | LMNAS100A4CA2CA9KMT2A | |
| SCHEMBL28882445 | 0.74 | ACHE (0.67) | ACHELMNAS100A4TRPV1GABRA1 | |
| SCHEMBL11305617 | 0.74 | ESR1 (0.57) | ESR1ESR2LMNACA2CA9 |
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 |