Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 16/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 16/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 16/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | TACR2 | P21452 | 1/20 | 0.33 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8857855 | 0.91 | FFAR1 (0.40) | SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL8961483 | 0.87 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3CYP2C9 | |
| SCHEMBL10479863 | 0.84 | SLC6A2 (0.34) | SLC6A2SLC6A4SLC6A3CYP2C9 | |
| SCHEMBL9349806 | 0.84 | SLC6A2 (0.34) | SLC6A2SLC6A4SLC6A3CYP2C9 | |
| SCHEMBL8435370 | 0.84 | SLC6A2 (0.34) | SLC6A2SLC6A4SLC6A3CYP2C9 | |
| SCHEMBL8857678 | 0.83 | APP (0.38) | SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4 | |
| SCHEMBL10729688 | 0.81 | TRPV3 (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9362197 | 0.80 | APP (0.39) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10039503 | 0.78 | TLR4 (0.33) | — | |
| SCHEMBL10479630 | 0.78 | KDM1A (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5637257-A | LIQUID CRYSTAL DISPLAYING | MERCK PATENT GESELLSCHAFT MLT BESCHRANKTER HAFTUNG (DE) | 1997-06-10 | — | — | US | disclosed |
| US-5482653-A | FOR LIQUID CRYSTAL DISPLAY | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-01-09 | — | — | US | disclosed |
| EP-0426815-B1 | FLUORINATED BIPHENYL DERIVATIVES | MERCK PATENT GMBH (DE) | 1994-12-14 | — | — | EP | disclosed |
| WO-1990015115-A1 | FLUORINATED BIPHENYL DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-12-13 | — | — | WO | disclosed |