Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 3/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | DRD4 | P21917 | 3/20 | 0.32 |
| ▸ | DRD3 | P35462 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | F10 | P00742 | 1/20 | 0.30 |
| ▸ | PLG | P00747 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11262388 | 0.85 | AMY1A (0.37) | AMY1APTGESMAPK1KDM4EALDH1A1 | |
| SCHEMBL11253114 | 0.85 | AMY1A (0.47) | AMY1AKDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL11262531 | 0.80 | AMY1A (0.41) | AMY1ANPC1RAB9A | |
| SCHEMBL11259880 | 0.79 | AMY1A (0.51) | AMY1ATDP1NPC1RAB9A | |
| SCHEMBL11255428 | 0.77 | ALDH1A1 (0.44) | AMY1AKDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL11266547 | 0.74 | RHEB (0.31) | — | |
| Hydrochloric Acid SCHEMBL11264419 | 0.74 | PDE5A (0.43) | KDM4EALDH1A1 | |
| SCHEMBL11253305 | 0.70 | NPC1 (0.48) | AMY1ATSHRMAPK1KDM4ENPC1 | |
| SCHEMBL11271429 | 0.70 | DRD3 (0.41) | AMY1ADRD3KDM4ENPC1ALDH1A1 | |
| SCHEMBL11251140 | 0.69 | ALDH1A1 (0.40) | AMY1AKDM4ENPC1ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4329459-A | ENDOPEROXIDE CYCLOXGENASE INHIBITORS | THE UPJOHN COMPANY (US) | 1982-05-11 | — | — | US | disclosed |