Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 18/20 | 0.52 |
| ▸ | CD38 | P28907 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9946715 | 1.00 | PTGES (0.52) | PTGESCD38TYK2 | |
| SCHEMBL9944897 | 0.90 | PTGES (0.43) | PTGESCD38 | |
| SCHEMBL9946840 | 0.89 | PTGES (0.43) | PTGESCD38 | |
| SCHEMBL9947006 | 0.84 | PTGES (0.53) | PTGESCD38TYK2 | |
| SCHEMBL9946585 | 0.84 | PTGES (0.53) | PTGESCD38TYK2 | |
| SCHEMBL9942023 | 0.84 | PTGES (0.47) | PTGESCD38TYK2 | |
| SCHEMBL9947009 | 0.83 | PTGES (0.48) | PTGES | |
| SCHEMBL9946603 | 0.83 | PTGES (0.48) | PTGES | |
| SCHEMBL9898307 | 0.82 | PTGES (0.50) | PTGES | |
| SCHEMBL9898308 | 0.82 | PTGES (0.50) | PTGES |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012076673-A1 | 6-AMINO-2-PHENYLAMINO-1H-BENZIMIDAZOLE-5-CARBOXAMIDE- DERIVATIVES AND THEIR USE AS MICROSOMAL PROSTAGLANDIN E2 SYNTHASE-1 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-14 | — | — | WO | disclosed |