Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.43 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.43 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 6/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.42 |
| ▸ | VNN1 | O95497 | 6/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1598429 | 1.00 | CYP2D6 (0.43) | CYP2D6DPP4DPP8DPP9DPP7 | |
| SCHEMBL1598802 | 0.96 | CYP2D6 (0.46) | CYP2D6DPP4DPP8DPP9DPP7 | |
| SCHEMBL4260140 | 0.86 | VNN1 (0.48) | HCRTR1HCRTR2VNN1 | |
| SCHEMBL4260135 | 0.86 | VNN1 (0.48) | HCRTR1HCRTR2VNN1 | |
| SCHEMBL1598978 | 0.85 | DPP4 (0.51) | CYP2D6DPP4DPP8DPP9DPP7 | |
| SCHEMBL1598980 | 0.85 | DPP4 (0.51) | CYP2D6DPP4DPP8DPP9DPP7 | |
| SCHEMBL889104 | 0.83 | PRMT5 (0.46) | CYP2D6DPP4DPP8DPP9DPP7 | |
| SCHEMBL7204445 | 0.83 | PRMT5 (0.46) | CYP2D6DPP4DPP8DPP9DPP7 | |
| SCHEMBL6761076 | 0.81 | VNN1 (0.45) | CYP2D6DPP4DPP8DPP9DPP7 | |
| SCHEMBL6761075 | 0.81 | VNN1 (0.45) | CYP2D6DPP4DPP8DPP9DPP7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100448874-C | N-aroyl cyclic amines | SMITHKLINE BEECHAM PLC (GB) | 2009-01-07 | — | — | CN | disclosed |
| CN-1633433-A | N-aroyl cyclic amines | SMITHKLINE BEECHAM PLC (GB) | 2005-06-29 | — | — | CN | disclosed |
| WO-2004041791-A1 | N-ARYL ACETYL CYCLIC AMINE DERIVATIVES AS OREXIN ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2004-05-21 | — | — | WO | disclosed |