Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | FAAH | O00519 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PNLIP | P16233 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9407615 | 1.00 | ALDH1A1 (0.58) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL8605437 | 1.00 | ALDH1A1 (0.58) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL8946795 | 0.94 | ALDH1A1 (0.50) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL9345586 | 0.92 | ALDH1A1 (0.53) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL1704751 | 0.91 | ALDH1A1 (0.64) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL10448638 | 0.87 | TSHR (0.43) | ALDH1A1TSHRKMT2AL3MBTL1NPC1 | |
| SCHEMBL1142463 | 0.86 | ALDH1A1 (0.72) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL17897419 | 0.86 | ALDH1A1 (0.59) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL7129914 | 0.86 | ALDH1A1 (0.59) | ALDH1A1FAAHTSHRCNR1CNR2 | |
| SCHEMBL9493320 | 0.86 | ALDH1A1 (0.59) | ALDH1A1FAAHTSHRCNR1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016100446-A2 | METHOD OF DETECTION OF VOLATILE ORGANIC COMPOUNDS USING LIQUID CRYSTALS THAT FORM A BLUE PHASE: AND DEVICE FOR STABILIZATION AND THICKNESS CONTROL OF LIQUID CRYSTAL FILMS | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2016-06-23 | — | — | WO | disclosed |