Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14440405 | 0.81 | ALDH1A1 (0.41) | ALDH1A1CHRM1L3MBTL1HTTDRD2 | |
| SCHEMBL27894922 | 0.81 | ALDH1A1 (0.41) | ALDH1A1CHRM1L3MBTL1HTTDRD2 | |
| SCHEMBL8682105 | 0.77 | CHRM1 (0.44) | CHRM1ACHECHRM3SMN1; SMN2CYP2D6 | |
| SCHEMBL8682408 | 0.77 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1HTTDRD2SMN1; SMN2 | |
| SCHEMBL31035277 | 0.74 | CYP3A4 (0.53) | ALDH1A1CHRM1CHRM3SMN1; SMN2CYP2D6 | |
| SCHEMBL27313162 | 0.71 | ALDH1A1 (0.33) | ALDH1A1L3MBTL1HTTDRD2SMN1; SMN2 | |
| SCHEMBL13523706 | 0.70 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1HTTSMN1; SMN2RAB9A | |
| SCHEMBL21673398 | 0.70 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1HTTSMN1; SMN2RAB9A | |
| SCHEMBL4072176 | 0.70 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1HTTSMN1; SMN2RAB9A | |
| SCHEMBL10305650 | 0.70 | — | — |
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-5843983-A | Diphenylethane compounds containing a saturated heterocyclic group, their preparation, and their therapeutic use | SANKYO COMPANY, LIMITED (JP) | 1998-12-01 | — | — | US | disclosed |