Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | CDC7 | O00311 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | EDNRB | P24530 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LIMK2 | P53671 | 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 | |
|---|---|---|---|---|
| SCHEMBL8633058 | 0.90 | PTGS2 (0.44) | ALDH1A1PTGS2TSHRPOLBGAA | |
| SCHEMBL8630170 | 0.90 | CDC7 (0.43) | ALDH1A1PTGS2CDC7TSHRPTGDR2 | |
| SCHEMBL8629928 | 0.89 | PTGS2 (0.43) | ALDH1A1PTGS2CDC7PTGDR2SMN1; SMN2 | |
| SCHEMBL8635531 | 0.88 | PTGS2 (0.50) | PTGS2CDC7POLBPTGDR2KMT2A | |
| SCHEMBL8629982 | 0.88 | EDNRB (0.43) | ALDH1A1PTGS2CDC7POLBPTGDR2 | |
| SCHEMBL8629114 | 0.87 | ALDH1A1 (0.36) | ALDH1A1PTGS2TSHRPOLBGAA | |
| SCHEMBL8634392 | 0.87 | PTGS2 (0.48) | ALDH1A1PTGS2TSHRPOLBGAA | |
| SCHEMBL8629104 | 0.87 | ALDH1A1 (0.36) | ALDH1A1PTGS2TSHRPOLBGAA | |
| SCHEMBL8631438 | 0.86 | CYP1A2 (0.46) | ALDH1A1PTGS2POLBGAAPTGDR2 | |
| SCHEMBL8632637 | 0.86 | EDNRB (0.40) | ALDH1A1PTGS2TSHRPOLBGAA |
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 |