Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 6/20 | 0.40 |
| ▸ | CA2 | P00918 | 6/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | APEX1 | P27695 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.38 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.34 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 4/20 | 0.34 |
| ▸ | CA9 | Q16790 | 4/20 | 0.34 |
| ▸ | PELI1 | Q96FA3 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8516177 | 0.73 | CA2 (0.40) | CA1CA2CA4APEX1POLB | |
| SCHEMBL8514468 | 0.73 | CYP3A4 (0.43) | PTGES2CA1CA2CA4APEX1 | |
| SCHEMBL8516119 | 0.72 | RXRA (0.49) | CA1CA2CA4CYP2C19CA12 | |
| SCHEMBL7952991 | 0.69 | APEX1 (0.67) | CA1CA2CA4APEX1POLB | |
| SCHEMBL7466976 | 0.68 | CSNK2A1 (0.47) | CA1CA2CSNK2A1CYP2C19ALDH1A1 | |
| SCHEMBL8516341 | 0.68 | CA1 (0.40) | CA1CA2CA4APEX1POLB | |
| SCHEMBL7584973 | 0.65 | CSNK2A1 (0.47) | CSNK2A1ALDH1A1FBP1CNR1 | |
| SCHEMBL8516285 | 0.65 | CA1 (0.52) | CA1CA2CA4APEX1POLB | |
| SCHEMBL4802797 | 0.65 | PTGES2 (0.47) | PTGES2CA2 | |
| SCHEMBL2919577 | 0.63 | CA2 (0.48) | PTGES2CA1CA2CA4APEX1 |
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 |