Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.34 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.32 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.31 |
| ▸ | CAMK1D | Q8IU85 | 1/20 | 0.31 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL17173648 | 0.89 | PTGS2 (0.37) | PTGS2LRRK2SCN10ASLC6A9PLA2G7 | |
| SCHEMBL17173638 | 0.63 | ALDH1A1 (0.45) | PTGS2LRRK2PTGS1CYP11B2 | |
| SCHEMBL17173636 | 0.62 | PTGS2 (0.36) | PTGS2PTGS1 | |
| SCHEMBL17177771 | 0.60 | PDE10A (0.33) | PTGS2KIF18AGPR119 | |
| SCHEMBL24587271 | 0.60 | CHRNB2 (0.42) | GPR119 | |
| SCHEMBL17173651 | 0.60 | LRRK2 (0.38) | LRRK2 | |
| SCHEMBL17173657 | 0.60 | LOXL2 (0.31) | PTGS2 | |
| SCHEMBL17173655 | 0.59 | HTT (0.38) | PTGS2POLBPTGS1 | |
| SCHEMBL18811837 | 0.59 | ALDH1A1 (0.41) | PTGS2LRRK2POLBPTGS1 | |
| SCHEMBL28602649 | 0.59 | GPR119 (0.39) | GPR119 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3495360-A1 | HETEROARYL SUBSTITUTED HETEROCYCLYL SULFONES | Grünenthal GmbH (DE) | 2019-06-12 | — | — | EP | disclosed |