Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.45 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.41 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL9488664 | 1.00 | CYP4F2 (0.45) | CYP4F2CYP4A11ALDH1A1UTS2RADRB2 | |
| SCHEMBL9490214 | 0.87 | ALDH1A1 (0.44) | CYP4F2CYP4A11ALDH1A1UTS2RADRB2 | |
| SCHEMBL9488481 | 0.87 | ALDH1A1 (0.44) | ALDH1A1ADRB2ADRB1ADRB3ESR1 | |
| SCHEMBL9488474 | 0.87 | ALDH1A1 (0.44) | ALDH1A1ADRB2ADRB1ADRB3ESR1 | |
| SCHEMBL9487484 | 0.85 | ALDH1A1 (0.52) | ALDH1A1UTS2RADRB2ADRB1ADRB3 | |
| SCHEMBL9489091 | 0.85 | TRPV1 (0.47) | CYP4F2CYP4A11ALDH1A1KMT2APOLB | |
| SCHEMBL9488833 | 0.84 | RARB (0.47) | ALDH1A1MEN1KMT2AMAPTPLA2G1B | |
| SCHEMBL9489031 | 0.83 | RARB (0.48) | ALDH1A1MEN1KMT2AMAPTPLA2G1B | |
| SCHEMBL9489400 | 0.83 | RARB (0.48) | ALDH1A1MEN1KMT2AMAPTPLA2G1B | |
| SCHEMBL9489407 | 0.83 | RARB (0.48) | ALDH1A1MEN1KMT2AMAPTPLA2G1B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0168043-B1 | LIQUID CRYSTAL PHASE | MERCK PATENT GmbH (DE) | 1990-11-07 | — | — | EP | claimed |
| US-5236618-A | Liquid crystal phase | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-08-17 | — | — | US | disclosed |
| EP-0168043-B1 | LIQUID CRYSTAL PHASE | MERCK PATENT GmbH (DE) | 1990-11-07 | — | — | EP | disclosed |
| US-4744918-A | Liquid crystal phase | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-05-17 | — | — | US | disclosed |
| EP-0168043-A2 | Liquid crystal phase | MERCK PATENT GmbH (DE) | 1986-01-15 | — | — | EP | disclosed |