Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.53 |
| ▸ | KDM1A | O60341 | 2/20 | 0.48 |
| ▸ | CCR5 | P51681 | 3/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | CTSA | P10619 | 1/20 | 0.47 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.46 |
| ▸ | USP25 | Q9UHP3 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.46 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.45 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.44 |
| ▸ | PPARD | Q03181 | 2/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8617145 | 1.00 | ERN1 (0.53) | ERN1KDM1ACCR5SLC6A4CTSA | |
| SCHEMBL8611236 | 0.91 | ERN1 (0.51) | ERN1KDM1ACTSARAB9AS1PR5 | |
| SCHEMBL8613905 | 0.91 | ERN1 (0.47) | ERN1KDM1ACCR5SLC6A4CTSA | |
| SCHEMBL8612822 | 0.90 | ERN1 (0.48) | ERN1KDM1ACCR5SLC6A4CTSA | |
| SCHEMBL8643887 | 0.90 | ERN1 (0.48) | ERN1KDM1ACCR5SLC6A4CTSA | |
| SCHEMBL8612887 | 0.89 | ERN1 (0.52) | ERN1KDM1ACTSARAB9AS1PR5 | |
| SCHEMBL224277 | 0.89 | KDM1A (0.55) | KDM1ACCR5SLC6A4USP28USP25 | |
| SCHEMBL30739242 | 0.89 | KDM1A (0.55) | KDM1ACCR5SLC6A4USP28USP25 | |
| SCHEMBL21162496 | 0.88 | ERN1 (0.59) | ERN1CTSAALDH1A1S1PR5FFAR1 | |
| SCHEMBL8617807 | 0.87 | KDM1A (0.46) | ERN1KDM1ACCR5SLC6A4USP28 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0665836-B1 | BIFUNCTIONAL INTERMEDIATES FOR USE IN THE MANUFACTURE OF LIQUID CRYSTALS | HOECHST AG (DE) | 1998-04-29 | — | — | EP | disclosed |
| WO-1994010152-A1 | BIFUNCTIONAL INTERMEDIATES FOR USE IN THE MANUFACTURE OF LIQUID CRYSTALS | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-05-11 | — | — | WO | disclosed |