Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9268003 | 0.80 | CA12 (0.36) | DRD3CA12CA1CA9 | |
| SCHEMBL6024905 | 0.79 | DRD3 (0.50) | DRD3 | |
| SCHEMBL8410875 | 0.74 | HCAR1 (0.32) | DRD3CA12CA1CA9 | |
| SCHEMBL28806180 | 0.69 | CYP19A1 (0.32) | CA12CA1CA9 | |
| SCHEMBL14721136 | 0.69 | SLC6A4 (0.37) | — | |
| SCHEMBL9159765 | 0.69 | HTR2C (0.40) | DRD3 | |
| SCHEMBL9300450 | 0.67 | TLR9 (0.32) | — | |
| SCHEMBL9157877 | 0.65 | DRD3 (0.32) | DRD3 | |
| SCHEMBL9159596 | 0.65 | DRD3 (0.32) | DRD3 | |
| SCHEMBL7532624 | 0.64 | CA12 (0.43) | CA12CA1CA9 |
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 4 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 |
| EP-0375404-A2 | Heterocyclic derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-06-27 | — | — | EP | disclosed |