Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | LPL | P06858 | 1/20 | 0.43 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8990730 | 1.00 | MAOB (0.57) | MAOBTAAR1ALDH1A1LMNAGAA | |
| SCHEMBL7552100 | 0.98 | MAOB (0.59) | MAOBTAAR1ALDH1A1LMNAGAA | |
| SCHEMBL17068942 | 0.91 | TAAR1 (0.56) | MAOBTAAR1ALDH1A1LMNAGAA | |
| SCHEMBL371244 | 0.91 | TAAR1 (0.56) | MAOBTAAR1ALDH1A1LMNAGAA | |
| Ammonia Solution, Strong SCHEMBL6187599 | 0.88 | TAAR1 (0.54) | MAOBTAAR1ALDH1A1LMNAGAA | |
| Hydrochloric Acid SCHEMBL7988601 | 0.88 | TAAR1 (0.54) | MAOBTAAR1ALDH1A1LMNAGAA | |
| SCHEMBL8990715 | 0.87 | RARB (0.55) | MAOBALDH1A1GAAHTTKMT2A | |
| SCHEMBL8990848 | 0.86 | L3MBTL1 (0.58) | MAOBTAAR1ALDH1A1LMNAGAA | |
| SCHEMBL8990579 | 0.86 | MAOB (0.48) | MAOBTAAR1ALDH1A1LMNAGAA | |
| SCHEMBL8990580 | 0.86 | MAOB (0.48) | MAOBTAAR1ALDH1A1LMNAGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5496499-A | Biphenylethanes and liquid-crystalline phase | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-03-05 | — | — | US | disclosed |
| EP-0429558-B1 | DIPHENYLYLETHANES AND LIQUID CRYSTALLINE PHASE | MERCK PATENT GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| WO-1990008757-A1 | DIPHENYLYLETHANES AND LIQUID CRYSTALLINE PHASE | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-08-09 | — | — | WO | disclosed |