Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.44 |
| ▸ | DRD4 | P21917 | 3/20 | 0.44 |
| ▸ | DRD3 | P35462 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL8790889 | 1.00 | DRD2 (0.44) | DRD2DRD4DRD3ALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL8858366 | 0.99 | DRD2 (0.43) | DRD2DRD4DRD3ALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL8858362 | 0.99 | DRD2 (0.43) | DRD2DRD4DRD3ALDH1A1HSD17B10 | |
| SCHEMBL8858342 | 0.88 | DRD2 (0.48) | DRD2DRD4DRD3SIGMAR1MAOB | |
| SCHEMBL8858344 | 0.88 | DRD2 (0.48) | DRD2DRD4DRD3SIGMAR1MAOB | |
| SCHEMBL8858363 | 0.85 | DRD2 (0.37) | DRD2DRD4DRD3SIGMAR1KDM4E | |
| SCHEMBL8858360 | 0.85 | DRD2 (0.37) | DRD2DRD4DRD3SIGMAR1KDM4E | |
| Hydrochloric Acid SCHEMBL8858358 | 0.85 | HTR1A (0.38) | DRD2DRD4DRD3KDM4ESMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8858356 | 0.85 | HTR1A (0.38) | DRD2DRD4DRD3KDM4ESMN1; SMN2 | |
| SCHEMBL8858371 | 0.83 | KDM4E (0.39) | DRD2DRD4DRD3ALDH1A1SIGMAR1 |
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-5665722-A | Benzofuran derivatives as D4 receptor antagonists | MERCK, SHARP & DOHME, LTD. (GB) | 1997-09-09 | — | — | US | disclosed |
| EP-0757686-A1 | BENZOFURAN DERIVATIVES AS D 4? RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 1997-02-12 | — | — | EP | disclosed |
| WO-1995029911-A1 | BENZOFURAN DERIVATIVES AS D4 RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1995-11-09 | — | — | WO | disclosed |