Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27772039 | 0.92 | RORC (0.31) | — | |
| Tert-Butyl Formate SCHEMBL28778039 | 0.88 | SLC22A12 (0.33) | — | |
| Tert-Butyl Formate SCHEMBL27720215 | 0.83 | MAPK14 (0.32) | — | |
| Tert-Butyl Formate SCHEMBL27720084 | 0.83 | KRAS (0.31) | — | |
| Tert-Butyl Formate SCHEMBL27751360 | 0.82 | — | — | |
| Tert-Butyl Formate SCHEMBL27699544 | 0.79 | PTGS2 (0.34) | PTGS2 | |
| Tert-Butyl Formate SCHEMBL27699536 | 0.68 | — | — | |
| Tert-Butyl Formate SCHEMBL27720083 | 0.68 | HTR6 (0.32) | — | |
| SCHEMBL27720066 | 0.66 | ALDH1A1 (0.37) | — | |
| SCHEMBL27751389 | 0.66 | RORC (0.32) | PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101495449-A | 2-phenyl-indoles as prostaglandin D2 receptor antagonists | SANOFI AVENTIS (FR) | 2009-07-29 | — | — | CN | disclosed |