Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 5/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 7/20 | 0.38 |
| ▸ | CA2 | P00918 | 7/20 | 0.38 |
| ▸ | CA9 | Q16790 | 6/20 | 0.38 |
| ▸ | CA12 | O43570 | 5/20 | 0.38 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL8629390 | 0.90 | PTGES2 (0.43) | PTGES2F10CA1CA2CA9 | |
| SCHEMBL8634777 | 0.88 | CA1 (0.40) | PTGES2F10CA1CA2CA9 | |
| SCHEMBL8627977 | 0.83 | PTGS2 (0.50) | PTGES2F10CA1CA2CA9 | |
| SCHEMBL8631662 | 0.82 | F10 (0.42) | PTGES2F10CA1CA2CA9 | |
| SCHEMBL7777653 | 0.81 | PTGS2 (0.48) | CA1CA2CA9CA12CA13 | |
| SCHEMBL8631083 | 0.80 | PTGES2 (0.53) | PTGES2F10CA1CA2CA9 | |
| SCHEMBL8629397 | 0.78 | ALOX5AP (0.40) | PTGES2CA1CA2CA9CA12 | |
| SCHEMBL8627632 | 0.78 | CA1 (0.42) | CA1CA2CA9CA12CYP2C9 | |
| SCHEMBL8627988 | 0.78 | CA2 (0.38) | CA1CA2CA9CA12MAPT | |
| SCHEMBL8631176 | 0.77 | PTGS2 (0.46) | PTGES2CA1CA2CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-5756530-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G. D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |