Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 17/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 9/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | MC4R | P32245 | 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 | |
|---|---|---|---|---|
| SCHEMBL8974446 | 0.85 | PTGS2 (0.47) | PTGS2PTGS1 | |
| SCHEMBL8974890 | 0.85 | PTGS2 (0.59) | PTGS2PTGS1 | |
| SCHEMBL8974060 | 0.84 | PTGS2 (0.64) | PTGS2PTGS1 | |
| SCHEMBL8974192 | 0.84 | PTGS2 (0.44) | PTGS2PTGS1ABCB11ALDH1A1MT-CO2 | |
| SCHEMBL8974296 | 0.84 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL8974347 | 0.82 | PTGS2 (0.62) | PTGS2PTGS1 | |
| SCHEMBL8974390 | 0.82 | PTGS2 (0.47) | PTGS2PTGS1ALDH1A1 | |
| SCHEMBL8770202 | 0.82 | PTGS2 (0.79) | PTGS2PTGS1 | |
| SCHEMBL1687503 | 0.82 | PTGS2 (0.79) | PTGS2PTGS1 | |
| SCHEMBL8974782 | 0.81 | CA2 (0.68) | PTGS2PTGS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5576339-A | Pyridyl substituted cyclopentadienes for the treatment of inflamation | HUANG HORNG-CHIH (US) | 1996-11-19 | — | — | US | disclosed |
| US-5418254-A | Side effect reduction | G. D. SEARLE & CO. (US) | 1995-05-23 | — | — | US | disclosed |