Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.49 |
| ▸ | KDM1A | O60341 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23798654 | 0.89 | OPRL1 (0.56) | CYP2D6OPRL1KDM1AOPRM1 | |
| SCHEMBL9435664 | 0.88 | OPRL1 (0.58) | CYP2D6OPRL1KDM1AOPRM1 | |
| SCHEMBL23799233 | 0.86 | DPP4 (0.51) | CYP2D6OPRL1OPRM1 | |
| SCHEMBL23798663 | 0.83 | CCR1 (0.41) | OPRL1OPRM1 | |
| SCHEMBL9435516 | 0.82 | CYP2D6 (0.46) | CYP2D6OPRL1KDM1AOPRM1 | |
| SCHEMBL23799161 | 0.82 | CYP2D6 (0.47) | CYP2D6KDM1AOPRM1 | |
| SCHEMBL23778458 | 0.82 | CYP2D6 (0.53) | CYP2D6OPRL1KDM1AOPRM1 | |
| SCHEMBL20066224 | 0.81 | KDM1A (0.48) | CYP2D6OPRL1KDM1AOPRM1 | |
| SCHEMBL20066032 | 0.81 | CYP2D6 (0.49) | CYP2D6OPRL1KDM1A | |
| SCHEMBL13654981 | 0.80 | OPRM1 (0.54) | CYP2D6OPRL1KDM1AOPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109996792-B | Heterocyclic compounds having activity as modulators of muscarinic M1 and/or M4 receptors in the treatment of CNS diseases and pain | 赫普泰雅治疗有限公司 | 2023-02-17 | — | — | CN | disclosed |