Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.46 |
| ▸ | PDE4A | P27815 | 3/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10979460 | 1.00 | KDM1A (0.46) | KDM1APDE4AESR2HTR2CHTR2B | |
| SCHEMBL11066243 | 0.92 | KDM1A (0.44) | KDM1APDE4AESR2PDE4BPDE4C | |
| SCHEMBL11062469 | 0.91 | THRA (0.44) | KDM1APDE4AESR2PDE4BPDE4C | |
| SCHEMBL11062485 | 0.91 | THRA (0.44) | KDM1APDE4AESR2PDE4BPDE4C | |
| SCHEMBL11063194 | 0.91 | THRA (0.44) | KDM1APDE4AESR2PDE4BPDE4C | |
| SCHEMBL11062982 | 0.91 | THRA (0.44) | KDM1APDE4AESR2PDE4BPDE4C | |
| SCHEMBL11066557 | 0.91 | THRA (0.44) | KDM1APDE4AESR2PDE4BPDE4C | |
| SCHEMBL12716160 | 0.88 | KDM1A (0.58) | KDM1APDE4AESR2POLBALDH1A1 | |
| SCHEMBL11062945 | 0.87 | KDM1A (0.45) | KDM1APDE4AHTR2CHTR2BHTR2A | |
| SCHEMBL11062947 | 0.87 | KDM1A (0.45) | KDM1APDE4AHTR2CHTR2BHTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4490305-A | Liquid-crystalline halogen compounds, process for their preparation, dielectrics containing these, and electro-optical display element | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1984-12-25 | — | — | US | disclosed |
| EP-0074608-A2 | Liquid crystal halogen compounds, process for their preparation, dielectric and dectrooptical display element containing them | MERCK PATENT GmbH (DE) | 1983-03-23 | — | — | EP | disclosed |