Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 18/20 | 0.79 |
| ▸ | PTGS1 | P23219 | 12/20 | 0.79 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.54 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | PTGES | O14684 | 1/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | PDE5A | O76074 | 1/20 | 0.54 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CA3 | P07451 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL213150 | 0.88 | PTGS2 (1.00) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL3243184 | 0.88 | PTGS2 (0.82) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL6352647 | 0.87 | PTGS2 (0.80) | PTGS2PTGS1ABCB11ALDH1A1CHRNA7 | |
| SCHEMBL27435791 | 0.86 | PTGS2 (0.75) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL3249718 | 0.86 | PTGS2 (0.95) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL7789562 | 0.86 | PTGS2 (0.78) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL212658 | 0.86 | PTGS2 (1.00) | PTGS2PTGS1ABCB11ALDH1A1CHRNA7 | |
| SCHEMBL6339240 | 0.86 | PTGS2 (1.00) | PTGS2PTGS1ABCB11ALDH1A1CHRNA7 | |
| SCHEMBL215341 | 0.85 | PTGS2 (1.00) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 | |
| SCHEMBL6339195 | 0.85 | PTGS2 (0.90) | PTGS2PTGS1ABCB11ALDH1A1PDPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1039914-A4 | CYCLOOXYGENASE-2 INHIBITION | CORNELL RES FOUNDATION INC (US) | 2007-06-27 | — | — | EP | disclosed |
| EP-1039914-A1 | CYCLOOXYGENASE-2 INHIBITION | CORNELL RESEARCH FOUNDATION, INC. (US) | 2000-10-04 | — | — | EP | disclosed |
| WO-1999030721-A1 | CYCLOOXYGENASE-2 INHIBITION | CORNELL RESEARCH FOUNDATION, INC. (US) | 1999-06-24 | — | — | WO | disclosed |