Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 18/20 | 0.50 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4026246 | 0.89 | LMNA (0.50) | CYP2C9 | |
| SCHEMBL4028870 | 0.83 | CYP1A2 (0.47) | CYP2C9 | |
| SCHEMBL4031373 | 0.82 | ABCG2 (0.52) | — | |
| SCHEMBL4026944 | 0.82 | CLK4 (0.47) | CYP2C9 | |
| SCHEMBL4025363 | 0.81 | ABCG2 (0.48) | — | |
| SCHEMBL4025241 | 0.80 | ACP1 (0.44) | — | |
| SCHEMBL4023370 | 0.76 | NT5E (0.49) | CYP2C9 | |
| SCHEMBL8269935 | 0.76 | PDE10A (0.62) | PDE10ACYP2C9 | |
| SCHEMBL4816411 | 0.75 | ABCG2 (0.52) | — | |
| SCHEMBL4021555 | 0.75 | NT5E (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1339690-B1 | N-TYPE CALCIUM CHANNEL ANTAGONISTS FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2009-01-21 | — | — | EP | disclosed |