Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 8/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL211891 | 0.90 | AURKA (0.56) | AURKAHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL13985593 | 0.89 | AURKA (0.45) | AURKAHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL13985474 | 0.87 | AURKA (0.52) | AURKACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL211129 | 0.86 | AURKA (0.48) | AURKAHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL210671 | 0.86 | AURKA (0.64) | AURKACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL210907 | 0.84 | AURKA (0.54) | AURKACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL211945 | 0.83 | AURKA (0.50) | AURKACYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL4757123 | 0.83 | AURKA (0.60) | AURKAKCNH2 | |
| SCHEMBL211046 | 0.83 | AURKA (0.49) | AURKAHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4790505 | 0.82 | AURKA (0.54) | AURKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009001021-A1 | IMIDAZOPYRIDINE DERIVATIVES USEFUL AS ENZYME INHIBITORS FOR THE TREATMENT OF CELL PROLIFERATIVE AND AUTOIMMUNE DISEASES | CHROMA THERAPEUTICS LTD. (GB) | 2008-12-31 | — | — | WO | disclosed |