Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 18/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 16/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2586824 | 0.82 | OPRD1 (0.44) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL2592703 | 0.81 | OPRD1 (0.36) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL2586790 | 0.81 | DDB1 (0.41) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL2592448 | 0.79 | OPRD1 (0.37) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL13339986 | 0.73 | OPRD1 (0.43) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| Hydrochloric Acid SCHEMBL3494214 | 0.72 | OPRD1 (0.43) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL14918914 | 0.70 | OPRD1 (0.40) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL2591939 | 0.70 | OPRD1 (0.39) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL14919156 | 0.68 | OPRD1 (0.39) | OPRD1KCNH2CYP2D6OPRK1OPRM1 | |
| SCHEMBL3492810 | 0.67 | GPR119 (0.42) | — |
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-2595989-A1 | HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | Vertex Pharmaceuticals Incorporated (US) | 2013-05-29 | — | — | EP | disclosed |
| WO-2011140425-A1 | HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-11-10 | — | — | WO | disclosed |