Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | APEX1 | P27695 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | BLM | P54132 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8514336 | 0.73 | PTGES2 (0.41) | CA1CA2CA4CNR1CA12 | |
| SCHEMBL5489312 | 0.73 | PTGES2 (0.46) | CA1CA2CA4CA12CA9 | |
| SCHEMBL8516341 | 0.71 | CA1 (0.40) | CA1CA2CA4CA9POLB | |
| SCHEMBL8590358 | 0.70 | CFTR (0.36) | POLBL3MBTL1ALDH1A1KDM4EMAPT | |
| SCHEMBL7952991 | 0.69 | APEX1 (0.67) | CYP3A4CA1CA2CA4CA12 | |
| SCHEMBL7812320 | 0.68 | ADORA2A (0.48) | CYP3A4POLBALDH1A1KDM4EMAPT | |
| SCHEMBL8588632 | 0.68 | TTR (0.41) | POLBTDP1ALDH1A1KDM4EMAPT | |
| SCHEMBL3262806 | 0.68 | PTGES2 (0.40) | CA1CA2CA4CA12CA9 | |
| SCHEMBL11119297 | 0.68 | CFTR (0.48) | CA1CA2CA4CA12CA9 | |
| SCHEMBL8516177 | 0.68 | CA2 (0.40) | CA1CA2CA4CNR1CA12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2457906-A1 | Derivatives of 1,2,4-benzothiadiazine dioxide, their preparation and use as allosteric modulators of the AMPA receptor | Universita'del Salento (IT) | 2012-05-30 | — | — | EP | disclosed |