Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.58 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.53 |
| ▸ | PIM1 | P11309 | 3/20 | 0.53 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.53 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.53 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.53 |
| ▸ | STK17A | Q9UEE5 | 3/20 | 0.53 |
| ▸ | MAP4K5 | Q9Y4K4 | 3/20 | 0.53 |
| ▸ | CLK2 | P49760 | 2/20 | 0.53 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.53 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.53 |
| ▸ | PRKD2 | Q9BZL6 | 2/20 | 0.53 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.53 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.53 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.47 |
| ▸ | PKN1 | Q16512 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7474098 | 0.84 | PARP1 (0.44) | PARP1MAP4K4PIM1PIM3AURKB | |
| SCHEMBL6585180 | 0.84 | DHODH (0.63) | PARP1DHODH | |
| SCHEMBL6810723 | 0.83 | PARP1 (0.63) | PARP1MAP4K4PIM1PIM3AURKB | |
| SCHEMBL6810480 | 0.82 | PARP1 (0.48) | PARP1PKN2PKN1DHODH | |
| SCHEMBL6948231 | 0.80 | PARP1 (0.69) | PARP1MAP4K4PIM1PIM3AURKB | |
| SCHEMBL6810422 | 0.78 | PKN1 (0.76) | PARP1MAP4K4PIM1PIM3AURKB | |
| SCHEMBL6804379 | 0.78 | ATM (0.52) | PARP1PKN2PKN1KMT2AATM | |
| SCHEMBL6585185 | 0.77 | HPSE (0.44) | PARP1DHODH | |
| SCHEMBL3574922 | 0.76 | PARP1 (0.56) | PARP1MAP4K4PIM1PIM3AURKB | |
| SCHEMBL31529624 | 0.76 | PARP1 (0.59) | PARP1KMT2AATM |
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 |