Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.59 |
| ▸ | UGCG | Q16739 | 1/20 | 0.59 |
| ▸ | CNR1 | P21554 | 3/20 | 0.44 |
| ▸ | CNR2 | P34972 | 3/20 | 0.44 |
| ▸ | PARP1 | P09874 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4025630 | 0.88 | NR1I2 (0.63) | NR1I2UGCGPARP1MAPK1POLB | |
| SCHEMBL14373978 | 0.84 | NR1I2 (0.59) | NR1I2UGCGCNR1CNR2PARP1 | |
| SCHEMBL4026572 | 0.84 | NR1I2 (0.58) | NR1I2UGCGCNR1CNR2PARP1 | |
| SCHEMBL4026622 | 0.84 | NR1I2 (0.61) | NR1I2UGCGPARP1MAPK1PARP2 | |
| SCHEMBL4030260 | 0.82 | NR1I2 (0.64) | NR1I2UGCGCNR1CNR2PARP1 | |
| SCHEMBL14373974 | 0.81 | NR1I2 (0.58) | NR1I2UGCGCNR1CNR2PARP1 | |
| SCHEMBL14373714 | 0.80 | NR1I2 (0.61) | NR1I2UGCGCNR1CNR2MAPK1 | |
| SCHEMBL14373676 | 0.80 | NR1I2 (0.61) | NR1I2UGCGCNR1CNR2PARP1 | |
| SCHEMBL14373763 | 0.80 | NR1I2 (0.56) | NR1I2UGCGMAPK1POLBKMT2A | |
| SCHEMBL4188750 | 0.80 | NR1I2 (0.65) | NR1I2UGCGCNR1CNR2PARP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2029535-A1 | ISOINDOLE DERIVATIVES USEFUL FOR TREATING PAIN, GASTROINTESTINAL DISEASES AND CANCER | AstraZeneca AB (SE) | 2009-03-04 | — | — | EP | disclosed |
| WO-2007139464-A1 | ISOINDOLE DERIVATIVES USEFUL FOR TREATING PAIN, GASTROINTESTINAL DISEASES AND CANCER | ASTRAZENECA AB (SE) | 2007-12-06 | — | — | WO | disclosed |