Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGPAT2 | O15120 | 7/20 | 0.52 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.49 |
| ▸ | ACP1 | P24666 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | TOP1 | P11387 | 1/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | NUDT1 | P36639 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5740159 | 0.91 | AGPAT2 (0.47) | AGPAT2MCHR1AURKAPDPK1TGFBR1 | |
| SCHEMBL5741808 | 0.90 | MCHR1 (0.50) | AGPAT2MCHR1ACP1TRPV1AURKA | |
| SCHEMBL5741794 | 0.90 | MCHR1 (0.50) | AGPAT2MCHR1ACP1TRPV1AURKA | |
| SCHEMBL5741921 | 0.90 | AGPAT2 (0.51) | AGPAT2ACP1AURKAPDPK1TGFBR1 | |
| SCHEMBL5742556 | 0.90 | AGPAT2 (0.61) | AGPAT2AURKAPDPK1TGFBR1ROCK1 | |
| SCHEMBL5740529 | 0.89 | MCHR1 (0.53) | AGPAT2MCHR1ACP1TRPV1AURKA | |
| SCHEMBL5742875 | 0.89 | AGPAT2 (0.57) | AGPAT2MCHR1ACP1TRPV1ROCK2 | |
| SCHEMBL5741991 | 0.89 | AGPAT2 (0.57) | AGPAT2MCHR1ACP1TRPV1ROCK2 | |
| SCHEMBL5741580 | 0.87 | ACP1 (0.48) | AGPAT2MCHR1ACP1HSP90AA1HSP90AB1 | |
| SCHEMBL5741884 | 0.86 | AGPAT2 (0.52) | AGPAT2MCHR1ACP1TRPV1AURKA |
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-1339706-B1 | N-TYPE CALCIUM CHANNEL ANTAGONISTS FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2006-04-19 | — | — | EP | disclosed |