Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | ESR1 | P03372 | 7/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | TYR | P14679 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14546614 | 0.84 | GABRA1 (0.39) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL1836851 | 0.79 | CA2 (0.54) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL10921220 | 0.78 | CA2 (0.46) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL26655650 | 0.76 | RIPK1 (0.36) | ESR1ESR2ALDH1A1TSHRTDP1 | |
| SCHEMBL6546355 | 0.76 | ALDH1A1 (0.36) | ALDH1A1TSHRTDP1 | |
| SCHEMBL11212180 | 0.74 | CA2 (0.65) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL56491 | 0.74 | CA2 (0.58) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL11278957 | 0.73 | CA2 (0.46) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL984525 | 0.73 | ALDH1A1 (0.56) | CA2ESR1ESR2GABRA1GABRB2 | |
| SCHEMBL7054598 | 0.73 | GABRA1 (0.50) | CA2GABRA1GABRB2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0942896-B1 | SUBSTITUTED PHENOLS AND THIOPHENOLS USEFUL AS ANTIOXIDANT AGENTS | AVENTIS PHARMA INC (US) | 2003-04-16 | — | — | EP | disclosed |