Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 14/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21791674 | 0.82 | KDM4E (0.38) | OPRL1CYP2D6 | |
| SCHEMBL24429464 | 0.79 | GNAI3 (0.49) | — | |
| SCHEMBL1104711 | 0.78 | KDM1A (0.40) | OPRL1MAPK1KDM1A | |
| SCHEMBL15141802 | 0.75 | OPRL1 (0.35) | OPRL1MAPK1KDM1A | |
| SCHEMBL1794700 | 0.71 | OPRL1 (0.41) | OPRL1CYP2D6 | |
| SCHEMBL239640 | 0.71 | — | — | |
| SCHEMBL30748813 | 0.70 | OPRL1 (0.36) | OPRL1MAPK1 | |
| SCHEMBL19669160 | 0.69 | OPRL1 (0.40) | OPRL1KDM1A | |
| SCHEMBL10343684 | 0.68 | GNAI3 (0.48) | OPRL1 | |
| SCHEMBL19966694 | 0.68 | POLB (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023003862-A1 | CXCR4 MODULATORS AND USES RELATED THERETO | EMORY UNIVERSITY (US) | 2023-01-26 | — | — | WO | disclosed |