Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 9/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | CXCR4 | P61073 | 7/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1698219 | 0.96 | DRD2 (0.38) | OPRL1KCNH2DRD2DRD3CXCR4 | |
| SCHEMBL1698223 | 0.93 | OPRL1 (0.40) | OPRL1KCNH2DRD2DRD3CXCR4 | |
| SCHEMBL1698226 | 0.92 | CXCR4 (0.41) | KCNH2CXCR4 | |
| SCHEMBL1701122 | 0.88 | CXCR4 (0.38) | KCNH2CXCR4 | |
| SCHEMBL1698196 | 0.88 | CXCR4 (0.43) | KCNH2CXCR4 | |
| SCHEMBL1698222 | 0.85 | CXCR4 (0.44) | KCNH2CXCR4 | |
| SCHEMBL19435835 | 0.83 | CXCR4 (0.40) | OPRL1KCNH2CXCR4 | |
| SCHEMBL1698203 | 0.83 | OPRL1 (0.34) | OPRL1KCNH2 | |
| SCHEMBL1698228 | 0.80 | OPRL1 (0.40) | OPRL1KCNH2DRD2DRD3CXCR4 | |
| SCHEMBL25515629 | 0.78 | OPRL1 (0.40) | OPRL1KCNH2DRD2CXCR4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2584916-A1 | ORGANIC COMPOUNDS | Givaudan SA (CH) | 2013-05-01 | — | — | EP | claimed |
| WO-2011160254-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2011-12-29 | — | — | WO | claimed |
| WO-2011161163-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2011-12-29 | — | — | WO | claimed |