Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Lithium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 17/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL7399401 | 0.85 | OPRD1 (0.54) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| Lithium Ion SCHEMBL4271330 | 0.77 | OPRD1 (0.46) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL9577755 | 0.70 | OPRD1 (0.59) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| Hydrochloric Acid SCHEMBL4284815 | 0.69 | OPRD1 (0.47) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL13676386 | 0.68 | OPRD1 (0.73) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL471197 | 0.68 | OPRD1 (0.73) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL12366064 | 0.68 | OPRD1 (0.60) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL1237576 | 0.68 | OPRD1 (0.80) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL19289109 | 0.67 | OPRD1 (0.66) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL467151 | 0.66 | OPRD1 (1.00) | OPRD1KCNH2OPRK1CYP2D6OPRM1 |
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-1232160-A1 | SPIRO(2H-1-BENZOPYRAN-2,4'-PIPERIDINE)DERIVATES AS GLYCINE TRANSPORT INHIBITORS | Akzo Nobel N.V. (NL) | 2002-08-21 | — | — | EP | disclosed |
| WO-2001036423-A1 | SPIRO(2H-1-BENZOPYRAN-2,4'-PIPERIDINE) DERIVATES AS GLYCINE TRANSPORT INHIBITORS | AKZO NOBEL N.V. (NL) | 2001-05-25 | — | — | WO | disclosed |