Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | P2RY6 | Q15077 | 4/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 10/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11056944 | 0.72 | PTGS2 (0.40) | PTGS2P2RY6CA12CA9ABCB1 | |
| SCHEMBL7269294 | 0.68 | CA12 (0.39) | PTGS2P2RY6CA12CA9ABCB1 | |
| SCHEMBL6995122 | 0.66 | ABCB1 (0.38) | ABCB1CYP2A6 | |
| SCHEMBL30806499 | 0.66 | PARP1 (0.55) | ABCB1ALDH1A1 | |
| SCHEMBL6999048 | 0.66 | PARP1 (0.55) | ABCB1ALDH1A1 | |
| SCHEMBL7002022 | 0.66 | NOS3 (0.43) | PTGS2P2RY6CA12CA9ABCB1 | |
| SCHEMBL8207143 | 0.66 | DRD2 (0.42) | PTGS2P2RY6ABCB1 | |
| SCHEMBL28309473 | 0.65 | PTGS2 (0.43) | PTGS2P2RY6CA12CA9ABCB1 | |
| SCHEMBL6664666 | 0.65 | PTGS2 (0.40) | PTGS2P2RY6CA12CA9ABCB1 | |
| SCHEMBL13387495 | 0.65 | PTGS2 (0.43) | PTGS2P2RY6CA12CA9ABCB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4988723-A | Hypotensive agents, vasodilation | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-01-29 | — | — | US | disclosed |
| EP-0344747-A1 | Benzopyran derivatives and processes for preparation thereof | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1989-12-06 | — | — | EP | disclosed |