Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | GCGR | P47871 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | QPCT | Q16769 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16154470 | 0.89 | MAOB (0.38) | ACHENPC1RAB9AMEN1ALOX15 | |
| SCHEMBL29511319 | 0.87 | MAOB (0.39) | ACHENPC1RAB9AMEN1KMT2A | |
| SCHEMBL20691031 | 0.87 | MAOB (0.39) | ACHENPC1RAB9AMEN1KMT2A | |
| SCHEMBL21325925 | 0.83 | ALKBH3 (0.35) | NPC1RAB9AMEN1KMT2APTGS2 | |
| SCHEMBL15213953 | 0.83 | MAPK14 (0.41) | MAPK14GCGRPTGS2 | |
| SCHEMBL15000652 | 0.79 | PSMB5 (0.46) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL13906327 | 0.79 | ACHE (0.50) | ACHEMAPK14NPC1RAB9AGCGR | |
| SCHEMBL257801 | 0.79 | ACHE (0.50) | ACHEMAPK14NPC1RAB9AGCGR | |
| SCHEMBL16154469 | 0.78 | CYP2A6 (0.43) | ACHEALOX15MAPT | |
| SCHEMBL27926878 | 0.76 | SMN1; SMN2 (0.46) | ACHEMAPK14NPC1RAB9AGCGR |
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-3101088-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | Merck Patent GmbH (DE) | 2016-12-07 | — | — | EP | disclosed |