Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 8/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.37 |
| ▸ | BRD4 | O60885 | 3/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13339981 | 0.72 | OPRD1 (0.43) | OPRD1KCNH2CYP2D6OPRK1 | |
| Hydrochloric Acid SCHEMBL3495476 | 0.71 | OPRD1 (0.42) | OPRD1KCNH2CYP2D6OPRK1 | |
| SCHEMBL12480913 | 0.70 | ATM (0.44) | OPRD1KCNH2CYP2D6OPRK1 | |
| SCHEMBL2589311 | 0.66 | OPRD1 (0.44) | OPRD1KCNH2CYP2D6OPRK1 | |
| SCHEMBL1269847 | 0.66 | HTT (0.38) | OPRD1KCNH2 | |
| SCHEMBL12482165 | 0.65 | MAOB (0.46) | OPRD1KCNH2CYP2D6MAOBOPRK1 | |
| SCHEMBL3457811 | 0.64 | OPRD1 (0.45) | OPRD1KCNH2CYP2D6OPRK1 | |
| SCHEMBL2591939 | 0.63 | OPRD1 (0.39) | OPRD1KCNH2CYP2D6OPRK1 | |
| SCHEMBL17276804 | 0.62 | OPRD1 (0.43) | OPRD1KCNH2CYP2D6OPRK1 | |
| SCHEMBL14972718 | 0.62 | EPHX2 (0.38) | OPRD1KCNH2CYP2D6 |
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-2279187-A1 | SPIROCYCLIC DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS | DAC S.r.l. (IT) | 2011-02-02 | — | — | EP | claimed |
| WO-2009127609-A1 | SPIROCYCLIC DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS | DAC S.R.L. (IT) | 2009-10-22 | — | — | WO | claimed |