Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 6/20 | 0.36 |
| ▸ | CDK9 | P50750 | 6/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 2/20 | 0.30 |
| ▸ | HTR7 | P34969 | 2/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9497095 | 0.90 | L3MBTL1 (0.36) | CCNT1CDK9CHRM3HTR1AHTR7 | |
| SCHEMBL1573631 | 0.87 | HDAC3 (0.35) | CCNT1CDK9CHRM3HTR1AHTR7 | |
| SCHEMBL9493652 | 0.86 | HDAC3 (0.34) | CCNT1CDK9HTR1AHTR7HDAC3 | |
| SCHEMBL9495402 | 0.85 | HDAC3 (0.34) | CCNT1CDK9HDAC3HDAC1HDAC2 | |
| SCHEMBL9497772 | 0.85 | HDAC3 (0.34) | CCNT1CDK9HDAC3HDAC1HDAC2 | |
| SCHEMBL9493536 | 0.85 | HDAC3 (0.34) | CCNT1CDK9HDAC3HDAC1HDAC2 | |
| SCHEMBL9493666 | 0.85 | HDAC3 (0.34) | CCNT1CDK9HDAC3HDAC1HDAC2 | |
| SCHEMBL9494383 | 0.85 | HDAC3 (0.34) | CCNT1CDK9HDAC3HDAC1HDAC2 | |
| SCHEMBL9494347 | 0.85 | HDAC3 (0.34) | CCNT1CDK9HDAC3HDAC1HDAC2 | |
| SCHEMBL10532861 | 0.81 | — | — |
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-5273680-A | A chiral tilted smectic liquid crystal based on terphenyls | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-12-28 | — | — | US | disclosed |
| EP-0329752-B1 | FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS | MERCK PATENT GmbH (DE) | 1993-03-17 | — | — | EP | disclosed |
| EP-0329752-A1 | FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS | MERCK PATENT GmbH (DE) | 1989-08-30 | — | — | EP | disclosed |