Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.62 |
| ▸ | PLA2G2A | P14555 | 6/20 | 0.59 |
| ▸ | THRA | P10827 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | PTGES | O14684 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8877434 | 0.94 | PLA2G2A (0.62) | PTGS2PLA2G2ATHRATHRB | |
| SCHEMBL3242276 | 0.93 | PTGS2 (0.60) | PTGS2PLA2G2ATHRATHRBPTGES | |
| SCHEMBL3246296 | 0.92 | PTGS2 (0.59) | PTGS2PLA2G2ATHRATHRBPTGES | |
| SCHEMBL3246589 | 0.89 | PTGS2 (0.80) | PTGS2PLA2G2A | |
| SCHEMBL8876716 | 0.89 | PLA2G2A (0.59) | PTGS2PLA2G2ATHRATHRBPTGES | |
| SCHEMBL9230125 | 0.88 | PTGS2 (0.79) | PTGS2PLA2G2APTGESALOX5 | |
| SCHEMBL8876622 | 0.87 | PLA2G2A (0.60) | PTGS2PLA2G2ATHRATHRBPTGES | |
| SCHEMBL8878924 | 0.86 | PLA2G2A (0.59) | PTGS2PLA2G2ATHRATHRBPTGES | |
| SCHEMBL7196880 | 0.83 | PTGS2 (0.79) | PTGS2PLA2G2A | |
| SCHEMBL8878256 | 0.81 | PLA2G2A (0.58) | PTGS2PLA2G2APTGESALOX5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996037469-A1 | N-BENZYLINDOL-3-YL PROPANIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1996-11-28 | — | — | WO | claimed |
| US-5604253-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS | MERCK FROSST CANADA, INC. (CA) | 1997-02-18 | — | — | US | disclosed |
| WO-1996037469-A1 | N-BENZYLINDOL-3-YL PROPANIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1996-11-28 | — | — | WO | disclosed |