Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8956883 | 1.00 | ALDH1A1 (0.46) | ALDH1A1MAPTTSHRMAPK1LMNA | |
| SCHEMBL9472302 | 1.00 | ALDH1A1 (0.46) | ALDH1A1MAPTTSHRMAPK1LMNA | |
| SCHEMBL8956819 | 0.92 | ALDH1A1 (0.45) | ALDH1A1MAPTTSHRMAPK1LMNA | |
| SCHEMBL8956942 | 0.92 | ALDH1A1 (0.45) | ALDH1A1MAPTTSHRMAPK1LMNA | |
| SCHEMBL8956924 | 0.87 | SLC1A5 (0.44) | ALDH1A1MAPTTSHRMAPK1LMNA | |
| SCHEMBL8956867 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MAPTTSHRMAPK1LMNA | |
| SCHEMBL17897419 | 0.84 | ALDH1A1 (0.59) | ALDH1A1MAPTTSHRFAAHNPC1 | |
| SCHEMBL7129914 | 0.84 | ALDH1A1 (0.59) | ALDH1A1MAPTTSHRFAAHNPC1 | |
| SCHEMBL7131644 | 0.84 | ALDH1A1 (0.59) | ALDH1A1MAPTTSHRFAAHNPC1 | |
| SCHEMBL14273580 | 0.84 | ALDH1A1 (0.59) | ALDH1A1MAPTTSHRFAAHNPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5486310-A | Liquid crystalline mixtures having a chiral tilted smectic phase | HOFFMANN-LA ROCHE INC. (US) | 1996-01-23 | — | — | US | disclosed |
| EP-0339414-B1 | Optically active diester | HOFFMANN LA ROCHE (CH) | 1993-12-01 | — | — | EP | disclosed |