Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | FBP1 | P09467 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 3/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14744256 | 0.99 | EPHX2 (0.55) | EPHX2EPHX1POLBALDH1A1GAA | |
| SCHEMBL14743089 | 0.81 | EPHX2 (0.61) | EPHX2EPHX1POLBALDH1A1L3MBTL1 | |
| SCHEMBL14743505 | 0.74 | EPHX2 (0.57) | EPHX2EPHX1POLBALDH1A1GAA | |
| SCHEMBL14743775 | 0.72 | ERCC5 (0.42) | ALDH1A1NPC1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL14743917 | 0.71 | KMT2A (0.44) | ALDH1A1NPC1KMT2AMEN1CYP1A2 | |
| SCHEMBL14743512 | 0.71 | KMT2A (0.64) | POLBALDH1A1L3MBTL1NPC1KMT2A | |
| SCHEMBL14743066 | 0.70 | KMT2A (0.47) | ALDH1A1GAAKMT2AMEN1CNR1 | |
| SCHEMBL14744258 | 0.70 | KMT2A (0.47) | ALDH1A1GAAKMT2AMEN1CNR1 | |
| SCHEMBL14743338 | 0.70 | KMT2A (0.47) | ALDH1A1GAAKMT2AMEN1CNR1 | |
| SCHEMBL12196177 | 0.69 | EPHX1 (1.00) | EPHX2EPHX1POLBALDH1A1NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2758370-A1 | PARP INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2014-07-30 | — | — | EP | claimed |
| WO-2013030205-A1 | PARP INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-03-07 | — | — | WO | claimed |
| EP-2758370-A1 | PARP INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2014-07-30 | — | — | EP | disclosed |
| WO-2013030205-A1 | PARP INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-03-07 | — | — | WO | disclosed |