Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 8/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 3/20 | 0.30 |
| ▸ | NOS1 | P29475 | 3/20 | 0.30 |
| ▸ | NOS2 | P35228 | 3/20 | 0.30 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9447144 | 1.00 | HTR2A (0.38) | HTR2AHTR2CAOC3ARMAOA | |
| SCHEMBL9447169 | 0.92 | HTR2A (0.37) | HTR2AHTR2CAOC3ARMAOA | |
| SCHEMBL9447161 | 0.92 | HTR2A (0.37) | HTR2AHTR2CAOC3ARMAOA | |
| SCHEMBL9447105 | 0.91 | HTR2A (0.38) | HTR2AHTR2CAOC3ARMAOA | |
| SCHEMBL9447112 | 0.91 | HTR2A (0.38) | HTR2AHTR2CAOC3ARMAOA | |
| SCHEMBL9406172 | 0.91 | HTR2A (0.36) | HTR2AHTR2CAOC3ARNOS3 | |
| SCHEMBL9406167 | 0.91 | HTR2A (0.36) | HTR2AHTR2CAOC3ARNOS3 | |
| SCHEMBL9447300 | 0.89 | HTR2A (0.36) | HTR2AHTR2CAOC3ARCYP2C9 | |
| SCHEMBL9447304 | 0.89 | HTR2A (0.36) | HTR2AHTR2CAOC3ARCYP2C9 | |
| SCHEMBL9447155 | 0.89 | HTR2A (0.36) | HTR2AHTR2CAOC3ARCYP2C9 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5211878-A | Difluorobenzonitrile derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-05-18 | — | — | US | disclosed |
| US-5178790-A | With excellent steepness of characteristics | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1993-01-12 | — | — | US | disclosed |
| EP-0332005-B1 | SUPERTWIST LIQUID-CRYSTAL DISPLAY | MERCK PATENT GmbH (DE) | 1992-09-09 | — | — | EP | disclosed |
| EP-0360851-A1 | SUPERTWIST LIQUID CRYSTAL DISPLAY | MERCK PATENT GmbH (DE) | 1990-04-04 | — | — | EP | disclosed |
| WO-1989008691-A1 | SUPERTWIST LIQUID CRYSTAL DISPLAY | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1989-09-21 | — | — | WO | disclosed |
| EP-0332005-A1 | Supertwist liquid-crystal display | MERCK PATENT GmbH (DE) | 1989-09-13 | — | — | EP | disclosed |