Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 16/20 | 0.65 |
| ▸ | PARP2 | Q9UGN5 | 8/20 | 0.57 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.51 |
| ▸ | INSR | P06213 | 1/20 | 0.51 |
| ▸ | CSF1R | P07333 | 1/20 | 0.51 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | FLT4 | P35916 | 1/20 | 0.51 |
| ▸ | FLT3 | P36888 | 1/20 | 0.51 |
| ▸ | CLK2 | P49760 | 1/20 | 0.51 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.51 |
| ▸ | ITK | Q08881 | 1/20 | 0.51 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.51 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.51 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.51 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.51 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.51 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.51 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.51 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4969641 | 0.88 | PARP1 (0.59) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL4968077 | 0.88 | PARP1 (0.74) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL4971299 | 0.86 | PARP1 (0.64) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL9989160 | 0.85 | PARP1 (0.77) | PARP1PARP2DHODH | |
| SCHEMBL4971493 | 0.85 | PARP1 (0.75) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL4971182 | 0.80 | PARP1 (0.73) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL4970604 | 0.79 | PARP1 (1.00) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL4972871 | 0.78 | PARP1 (0.72) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL4973364 | 0.78 | MAP4K4 (0.76) | PARP1PARP2MAP4K4INSRCSF1R | |
| SCHEMBL4968533 | 0.76 | PARP1 (0.74) | PARP1PARP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012038751-A3 | PROCESS FOR THE PURIFICATION OF AROMATIC DICARBOXYLIC ACID | DAVY PROCESS TECHNOLOGY LIMITED (GB) | 2012-05-10 | — | — | WO | disclosed |
| EP-1957477-B1 | 1H-BENZIMIDAZOLE-4-CARBOXAMIDES SUBSTITUTED WITH PHENYL AT THE 2-POSITION ARE POTENT PARP INHIBITORS | ABBOTT LAB (US) | 2011-12-07 | — | — | EP | disclosed |