Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15543215 | 0.79 | OPRM1 (0.43) | ALDH1A1OPRM1CHRM1KCNH2OPRD1 | |
| SCHEMBL18115648 | 0.78 | ALDH1A1 (0.58) | ALDH1A1OPRM1GRIN2DGRIN3BCHRM2 | |
| SCHEMBL23748773 | 0.76 | OPRM1 (0.37) | ALDH1A1OPRM1GRIN2DGRIN3BGRIN1 | |
| SCHEMBL24421814 | 0.76 | ALDH1A1 (0.37) | ALDH1A1OPRM1GRIN2DGRIN3BCHRM2 | |
| SCHEMBL15544188 | 0.75 | OPRM1 (0.47) | ALDH1A1OPRM1GRIN2BOPRD1OPRK1 | |
| SCHEMBL20341691 | 0.71 | — | — | |
| SCHEMBL24422423 | 0.71 | ALDH1A1 (0.33) | ALDH1A1KCNH2 | |
| SCHEMBL15212418 | 0.71 | LMNA (0.34) | ALDH1A1MAPT | |
| SCHEMBL23748779 | 0.67 | CCR1 (0.42) | ALDH1A1OPRM1GRIN2DGRIN3BCHRM2 | |
| SCHEMBL16936786 | 0.67 | MAPT (0.51) | ALDH1A1OPRM1OPRD1OPRK1OPRL1 |
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-2601190-A1 | ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS | AH USA 42 LLC (US) | 2013-06-12 | — | — | EP | disclosed |
| WO-2012017359-A1 | ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS | PFIZER INC. (US) | 2012-02-09 | — | — | WO | disclosed |