Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CCR5 | P51681 | 12/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13961369 | 0.84 | KCNA3 (0.62) | KCNA3CYP2D6CCR5SIGMAR1OPRL1 | |
| SCHEMBL13960303 | 0.81 | KCNA3 (0.66) | KCNA3CYP2D6CCR5SIGMAR1OPRL1 | |
| SCHEMBL3940343 | 0.78 | KCNA3 (0.62) | KCNA3CYP2D6CCR5OPRL1OPRM1 | |
| SCHEMBL13961156 | 0.78 | KCNA3 (0.58) | KCNA3CYP2D6CCR5OPRL1OPRM1 | |
| SCHEMBL13960301 | 0.78 | KCNA3 (0.58) | KCNA3CCR5OPRL1OPRM1 | |
| SCHEMBL2409153 | 0.78 | CXCR4 (0.62) | SIGMAR1 | |
| SCHEMBL10039407 | 0.75 | KCNA3 (1.00) | KCNA3CYP2D6CCR5SIGMAR1OPRL1 | |
| Hydrochloric Acid SCHEMBL3678649 | 0.74 | KCNA3 (0.69) | KCNA3CYP2D6CCR5SIGMAR1OPRL1 | |
| SCHEMBL6705454 | 0.73 | KCNA3 (0.67) | KCNA3CYP2D6CCR5SIGMAR1OPRL1 | |
| SCHEMBL13929169 | 0.73 | CCR5 (0.61) | KCNA3CCR5SIGMAR1 |
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-2009010479-A2 | HETEROCYCLIC METHYLENE PIPERIDINE DERIVATIVES AND THEIR USE | EUROSCREEN S.A. (BE) | 2009-01-22 | — | — | WO | disclosed |