Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.55 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SCN8A | Q9UQD0 | 3/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.35 |
| ▸ | MERTK | Q12866 | 1/20 | 0.35 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL806942 | 1.00 | OPRM1 (0.55) | OPRM1OPRD1ABCB1KDM4EALDH1A1 | |
| SCHEMBL807652 | 0.86 | SIGMAR1 (0.47) | OPRM1OPRD1ABCB1SCN8A | |
| SCHEMBL15084341 | 0.81 | OPRM1 (0.58) | OPRM1OPRD1ABCB1KDM4EALDH1A1 | |
| SCHEMBL807486 | 0.80 | ALDH1A1 (0.51) | KDM4EALDH1A1POLBCYP2A13 | |
| SCHEMBL7121079 | 0.80 | ALDH1A1 (0.51) | KDM4EALDH1A1POLBCYP2A13 | |
| SCHEMBL15084343 | 0.78 | OPRM1 (0.46) | OPRM1OPRD1ABCB1KDM4EALDH1A1 | |
| SCHEMBL807317 | 0.77 | OPRM1 (0.54) | OPRM1OPRD1ABCB1KDM4EALDH1A1 | |
| SCHEMBL21777265 | 0.76 | OPRM1 (0.44) | OPRM1OPRD1SCN8A | |
| SCHEMBL30662730 | 0.76 | OPRM1 (0.44) | OPRM1OPRD1SCN8A | |
| SCHEMBL15081992 | 0.75 | OPRM1 (0.43) | OPRM1OPRD1ABCB1KDM4EALDH1A1 |
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-2012036997-A1 | FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS | SCHERING CORPORATION (US) | 2012-03-22 | — | — | WO | disclosed |