Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9508933 | 0.95 | APP (0.49) | APPESR2DRD2GRM3KCNH2 | |
| SCHEMBL13433641 | 0.95 | APP (0.49) | APPESR2DRD2GRM3KCNH2 | |
| SCHEMBL170548 | 0.91 | ESR2 (0.53) | ESR2DRD2MEN1ALDH1A1MAPK1 | |
| SCHEMBL9512520 | 0.85 | ESR2 (0.42) | ESR2MCHR1 | |
| SCHEMBL803244 | 0.85 | ESR2 (0.59) | ESR2MCHR1DRD2MEN1ALDH1A1 | |
| SCHEMBL9742692 | 0.84 | SLC6A2 (0.42) | APPESR2DRD2MEN1ALDH1A1 | |
| SCHEMBL9512417 | 0.84 | MCHR1 (0.47) | APPMCHR1DRD2MEN1ALDH1A1 | |
| SCHEMBL9742686 | 0.84 | SLC6A2 (0.42) | APPESR2DRD2MEN1ALDH1A1 | |
| SCHEMBL9509946 | 0.83 | HRH3 (0.44) | ESR2MCHR1ALDH1A1RAB9A | |
| SCHEMBL9510023 | 0.83 | RAB9A (0.50) | MCHR1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |