Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 9/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6804460 | 0.83 | PARP1 (0.63) | PARP1PARP2DHODHCHEK2PLK4 | |
| SCHEMBL3579908 | 0.79 | PARP1 (0.61) | PARP1PARP2DHODHCHEK2TNKS | |
| SCHEMBL6806674 | 0.76 | PARP1 (0.39) | PARP1DHODHCHEK2PLK4MAPK13 | |
| SCHEMBL6807301 | 0.74 | PARP1 (0.39) | PARP1DHODHCHEK2PLK4MAPK13 | |
| SCHEMBL6807111 | 0.73 | PARP1 (0.46) | PARP1PARP2DHODHCHEK2TNKS | |
| SCHEMBL6801835 | 0.73 | AURKB (0.44) | PARP1PARP2DHODHCHEK2TNKS | |
| SCHEMBL6806401 | 0.73 | GRM2 (0.52) | PARP1PARP2DHODHPLK4MAP4K4 | |
| SCHEMBL6589916 | 0.72 | TUBB4A (0.44) | PARP1PKMPARP2DHODHTUBB4A | |
| SCHEMBL6809996 | 0.71 | PKN1 (0.63) | PARP1PARP2DHODHCHEK2PLK4 | |
| SCHEMBL2149454 | 0.71 | PARP1 (0.63) | PARP1PARP2DHODHCHEK2TNKS |
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 |
|---|---|---|---|---|---|---|---|
| US-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |