Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6171874 | 0.90 | PTGS2 (0.61) | PTGS2L3MBTL1 | |
| SCHEMBL6170112 | 0.85 | PTGS2 (0.59) | PTGS2 | |
| SCHEMBL6170849 | 0.82 | KDM4E (0.54) | PTGS2KDM4EALDH1A1GAAMAPT | |
| SCHEMBL8179023 | 0.82 | SRD5A2 (0.51) | PTGS2KDM4EALDH1A1GAAMAPT | |
| SCHEMBL6173821 | 0.81 | KDM4E (0.50) | PTGS2KDM4EALDH1A1GAAMAPT | |
| SCHEMBL8181821 | 0.80 | ALOX15 (0.46) | PTGS2KDM4EALDH1A1GAAMAPT | |
| SCHEMBL8166727 | 0.79 | KDM4E (0.50) | PTGS2KDM4EALDH1A1GAAMAPT | |
| SCHEMBL6168973 | 0.79 | PTGS2 (0.57) | PTGS2 | |
| SCHEMBL6169769 | 0.79 | PTGS2 (0.59) | PTGS2 | |
| SCHEMBL8173929 | 0.78 | GAA (0.46) | PTGS2KDM4EALDH1A1GAAMAPT |
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-1045833-B1 | 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS | PFIZER (US) | 2005-11-02 | — | — | EP | claimed |