Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 3/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MRGPRX1 | Q96LB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3694861 | 0.92 | PTGS2 (0.37) | PTGESPTGS2MAOBMRGPRX1 | |
| SCHEMBL1079351 | 0.91 | PTGES (0.38) | PTGESPTGS2MAOBMRGPRX1 | |
| SCHEMBL3697908 | 0.90 | PTGES (0.36) | PTGESPTGS2MRGPRX1 | |
| SCHEMBL3694433 | 0.89 | PTGS2 (0.36) | PTGESPTGS2MRGPRX1 | |
| SCHEMBL1177996 | 0.88 | PTGES (0.48) | PTGESPTGS2 | |
| SCHEMBL1178612 | 0.87 | PTGES (0.40) | PTGESPTGS2MAOB | |
| SCHEMBL1177252 | 0.83 | PTGS2 (0.50) | PTGESPTGS2 | |
| SCHEMBL1081836 | 0.83 | PTGES (0.45) | PTGESPTGS2MAOBMRGPRX1 | |
| SCHEMBL3700948 | 0.82 | MAOB (0.34) | PTGESMAOB | |
| SCHEMBL3695678 | 0.81 | KMT2A (0.43) | MAOBKMT2A |
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-2268625-B1 | OXO-HETEROCYCLIC SUBSTITUTED CARBOXYLIC ACID DERIVATES AND THE USE THEREOF | Bayer Pharma AG (DE) | 2012-05-16 | — | — | EP | disclosed |