Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17993481 | 0.89 | ESR1 (0.48) | LMNAESR1ESR2ALDH1A1ATM | |
| SCHEMBL11305617 | 0.82 | ESR1 (0.57) | LMNAESR1ESR2ALDH1A1ATM | |
| SCHEMBL2891199 | 0.79 | ATM (0.49) | LMNAESR1ESR2ALDH1A1ATM | |
| SCHEMBL5846779 | 0.78 | LMNA (0.61) | LMNAESR1ESR2ALDH1A1TDP1 | |
| SCHEMBL5707613 | 0.77 | ALDH1A1 (0.54) | LMNAALDH1A1TDP1CA2CA9 | |
| SCHEMBL17993459 | 0.76 | SCN2A (0.43) | MEN1GAACASP6KMT2ASCN2A | |
| SCHEMBL19380491 | 0.75 | LMNA (0.71) | LMNAALDH1A1TDP1CA2CA9 | |
| SCHEMBL17993476 | 0.74 | ACHE (0.49) | LMNAESR1ESR2ALDH1A1CA2 | |
| SCHEMBL19380392 | 0.74 | ESR1 (0.40) | LMNAESR1ESR2ALDH1A1ATM | |
| SCHEMBL17993531 | 0.73 | LMNA (0.50) | LMNAESR1ESR2ALDH1A1TDP1 |
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 |