Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | TOP1 | P11387 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7984541 | 0.83 | PTGS2 (0.53) | PPARGPTGS2PPARACYSLTR2CYSLTR1 | |
| SCHEMBL28218194 | 0.83 | PPARG (0.47) | PPARGALOX5PTGS2HTR1APPARA | |
| SCHEMBL13864552 | 0.81 | PPARG (0.46) | PPARGALOX5PTGS2HTR1APPARA | |
| SCHEMBL6679792 | 0.81 | PPARG (0.46) | PPARGALOX5PTGS2HTR1APPARA | |
| SCHEMBL28446303 | 0.81 | PPARG (0.63) | PPARGALOX5PTGS2HTR1APPARA | |
| SCHEMBL30606586 | 0.79 | PPARG (0.60) | PPARGALOX5PTGS2HTR1APPARA | |
| SCHEMBL6686117 | 0.79 | PPARG (0.44) | PPARGALOX5PTGS2HTR1AMEN1 | |
| SCHEMBL8674421 | 0.78 | PPARG (0.46) | PPARGALOX5PTGS2HTR1APPARA | |
| SCHEMBL7998522 | 0.78 | TSHR (0.47) | PPARGMEN1KMT2ATSHRMAPT | |
| 1,2-Dimethoxybenzene SCHEMBL15206586 | 0.78 | CA1 (0.65) | ALOX5PTGS2HTR1APPARAMEN1 |
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-6284918-B1 | ENZYME INHIBITORS | VANDERBILT UNIVERSITY | 2001-09-04 | — | — | US | disclosed |