Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL29720293 | 0.94 | NT5E (0.35) | NT5EOPRM1KCNH2HDAC6KDM4E | |
| SCHEMBL18526368 | 0.94 | NT5E (0.35) | NT5EOPRM1KCNH2HDAC6KDM4E | |
| SCHEMBL29406990 | 0.92 | OPRM1 (0.36) | NT5EOPRM1KCNH2HDAC6KDM4E | |
| SCHEMBL18526374 | 0.92 | OPRM1 (0.36) | NT5EOPRM1KCNH2HDAC6KDM4E | |
| SCHEMBL23029077 | 0.91 | OPRM1 (0.34) | NT5EOPRM1KCNH2HDAC6KDM4E | |
| SCHEMBL24942970 | 0.91 | NT5E (0.35) | NT5EOPRM1KCNH2 | |
| SCHEMBL30112665 | 0.91 | NT5E (0.35) | NT5EOPRM1KCNH2 | |
| SCHEMBL23029076 | 0.90 | OPRM1 (0.35) | NT5EOPRM1KCNH2KDM4EALDH1A1 | |
| SCHEMBL24942508 | 0.83 | NT5E (0.40) | NT5EOPRM1KCNH2HDAC6SMN1; SMN2 | |
| SCHEMBL30112567 | 0.83 | NT5E (0.40) | NT5EOPRM1KCNH2HDAC6SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3293230-A1 | CELL-PENETRATING FLUORESCENT DYES WITH SECONDARY ALCOHOL FUNCTIONALITIES | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2018-03-14 | — | — | EP | disclosed |