Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.46 |
| ▸ | TOP2A | P11388 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | TNKS | O95271 | 2/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7236878 | 0.99 | PARP1 (0.46) | PARP1TOP2AESR1KDRBCHE | |
| SCHEMBL6203062 | 0.84 | PARP1 (0.46) | PARP1TOP2AESR1KDRTNKS | |
| Hydrochloric Acid SCHEMBL7235812 | 0.83 | PARP1 (0.45) | PARP1TOP2AESR1KDRTNKS | |
| SCHEMBL6202601 | 0.83 | KDM4E (0.47) | PARP1TOP2AESR1KDRTNKS | |
| SCHEMBL6197999 | 0.83 | TOP2A (0.54) | PARP1TOP2AESR1TNKSALK | |
| Hydrochloric Acid SCHEMBL7236341 | 0.82 | KDM4E (0.46) | PARP1TOP2AESR1KDRTNKS | |
| Hydrochloric Acid SCHEMBL7236484 | 0.82 | TOP2A (0.53) | PARP1TOP2AESR1TNKSALK | |
| Hydrochloric Acid SCHEMBL7227302 | 0.78 | PARP1 (0.35) | PARP1TOP2AESR1MAOAMAOB | |
| Hydrochloric Acid SCHEMBL7227308 | 0.78 | PARP1 (0.35) | PARP1TOP2AESR1MAOAMAOB | |
| SCHEMBL6203316 | 0.74 | PARP1 (0.47) | PARP1TOP2AESR1KDRMAOA |
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-1266887-B1 | Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2005-08-17 | — | — | EP | disclosed |
| EP-1266887-A2 | Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them | Les Laboratoires Servier (FR) | 2002-12-18 | — | — | EP | disclosed |