Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.49 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ACLY | P53396 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SDHB | P21912 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3316267 | 0.80 | STS (0.49) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9301525 | 0.79 | P2RY14 (0.46) | ALOX5P2RY14DRD2DRD3 | |
| SCHEMBL4479842 | 0.78 | SLC6A3 (0.46) | PTGS2EGFRDRD2DRD3ALDH1A1 | |
| SCHEMBL9300644 | 0.78 | P2RY14 (0.78) | ALOX5P2RY14HPGD | |
| SCHEMBL2113911 | 0.78 | STS (0.47) | ALDH1A1 | |
| SCHEMBL2926113 | 0.78 | EGFR (0.51) | ALOX5P2RY14PTGS2EGFRALDH1A1 | |
| SCHEMBL36203 | 0.77 | PTGS2 (0.55) | PTGS2EGFRACLYALDH1A1HPGD | |
| SCHEMBL731053 | 0.77 | CA12 (0.45) | PTGS2EGFRACLYSDHBPDK2 | |
| SCHEMBL9022881 | 0.77 | P2RY14 (0.48) | ALOX5P2RY14HPGDSMN1; SMN2 | |
| SCHEMBL25314535 | 0.76 | NOTUM (0.45) | ALDH1A1NPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5308852-A | Cardiovascular disorders | MERCK FROSST CANADA, INC. (CA) | 1994-05-03 | — | — | US | disclosed |
| EP-0579304-A1 | Heteroarylnaphthalenes as inhibitors of leukotriene biosynthesis | MERCK FROSST CANADA INC. (CA) | 1994-01-19 | — | — | EP | disclosed |
| WO-1994000444-A1 | HETEROARYLNAPHTHALENES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS | MERCK FROSST CANADA INC. (CA) | 1994-01-06 | — | — | WO | disclosed |