Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 5/20 | 0.48 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 5/20 | 0.47 |
| ▸ | DRD3 | P35462 | 5/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10498419 | 0.92 | CYP1A1 (0.54) | CYP1A1SIRT6DRD2DRD3S1PR1 | |
| SCHEMBL10498805 | 0.88 | SIRT6 (0.46) | SIRT6DRD2DRD3LMNAMAPT | |
| SCHEMBL6224468 | 0.86 | DRD2 (0.47) | SIRT6DRD2DRD3LMNAMAPT | |
| SCHEMBL31011685 | 0.81 | MAPT (0.56) | SIRT6LMNAMAPTALDH1A1KCNH2 | |
| SCHEMBL3710958 | 0.80 | DRD2 (0.52) | CYP1A1DRD2DRD3S1PR1KCNH2 | |
| SCHEMBL5362388 | 0.80 | SIRT6 (0.54) | SIRT6LMNAMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL13666661 | 0.80 | LMNA (0.47) | SIRT6LMNAMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL14698020 | 0.79 | DRD2 (0.65) | CYP1A1DRD2DRD3S1PR1KCNH2 | |
| SCHEMBL14119519 | 0.78 | CYP1A1 (0.65) | CYP1A1 | |
| SCHEMBL4710512 | 0.78 | LMNA (0.45) | SIRT6DRD2DRD3LMNAMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4861879-A | VAGINAL FUNGICIDE | JANSSEN PHARMACEUTICA N.V. (BE) | 1989-08-29 | — | — | US | disclosed |
| EP-0118138-B1 | ((4-(4-(4-PHENYL-1-PIPERAZINYL)PHENOXYMETHYL)-1,3-DIOXOLAN-2-YL)METHYL)-1H-IMIDAZOLES AND 1H-1,2,4-TRIAZOLES | JANSSEN PHARMACEUTICA N.V. (BE) | 1989-06-14 | — | — | EP | disclosed |
| US-4735942-A | FUNGICIDE, BACTERICIDE PARTICULARLY FOR UROGENITAL DISORDERS | JANSSEN PHARMACEUTICA, N.V. (BE) | 1988-04-05 | — | — | US | disclosed |
| US-4619931-A | BACTERICIDES, FUNGICIDES | JANSSEN PHARMACEUTICA, N.V. (BE) | 1986-10-28 | — | — | US | disclosed |
| EP-0118138-A1 | ((4-(4-(4-Phenyl-1-piperazinyl)phenoxymethyl)-1,3-dioxolan-2-yl)methyl)-1H-imidazoles and 1H-1,2,4-triazoles | JANSSEN PHARMACEUTICA N.V. (BE) | 1984-09-12 | — | — | EP | disclosed |