Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28733255 | 0.86 | APP (0.73) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17312253 | 0.86 | APP (0.73) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL30495998 | 0.86 | APP (0.73) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL403663 | 0.86 | APP (0.73) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9121457 | 0.83 | APP (0.69) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9433745 | 0.79 | APP (0.55) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8866806 | 0.77 | APP (0.41) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| Diphenylacetylene SCHEMBL27339044 | 0.76 | APP (0.92) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL789416 | 0.76 | APP (0.58) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15313378 | 0.76 | APP (0.58) | APPMAPTCYP1A2CYP3A4CYP2C9 |
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-5686520-A | Substituted 1,4-diphenylbutadiynes and oligomers thereof as polymer fluidizers and resins | AEROJET-GENERAL CORPORATION (US) | 1997-11-11 | — | — | US | disclosed |