Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.49 |
| ▸ | MT-CO2 | P00403 | 2/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8895853 | 0.85 | PTGS2 (0.52) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL10154022 | 0.82 | ALDH1A1 (0.53) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL5069872 | 0.82 | PTGS2 (0.72) | PTGS2MT-CO2NR4A2ALDH1A1NPSR1 | |
| SCHEMBL6990229 | 0.82 | PTGS2 (0.69) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8894627 | 0.80 | PTGS2 (0.55) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8896453 | 0.79 | PTGS2 (0.54) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8911333 | 0.78 | ALDH1A1 (0.53) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL3052006 | 0.76 | PTGS2 (0.54) | PTGS2MT-CO2MEN1GAAKMT2A | |
| SCHEMBL8897672 | 0.75 | PTGS2 (0.49) | PTGS2MT-CO2NR4A2MEN1GAA | |
| SCHEMBL8477426 | 0.74 | PTGS2 (0.56) | PTGS2MT-CO2MEN1GAAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997038986-A1 | SUBSTITUTED BENZENESULFONAMIDE DERIVATIVES AS PRODRUGS OF COX-2 INHIBITORS | G.D. SEARLE & CO. (US) | 1997-10-23 | — | — | WO | claimed |