Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.39 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 2/20 | 0.39 |
| ▸ | RARG | P13631 | 2/20 | 0.39 |
| ▸ | TYR | P14679 | 2/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MIF | P14174 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27991629 | 0.88 | RXRA (0.42) | CA2CA1CYP2C9ALDH1A1ALOX15 | |
| SCHEMBL26179235 | 0.86 | PTGS1 (0.42) | CA2CA1RARBRARGPGR | |
| SCHEMBL26179236 | 0.81 | KIF11 (0.60) | CA2CA1ALDH1A1HSD17B10TSHR | |
| SCHEMBL18213819 | 0.79 | PIK3CA (0.43) | CA2CA1PTGS2KIF11 | |
| SCHEMBL19387989 | 0.78 | MAP4K4 (0.51) | CYP1A2ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL18213821 | 0.77 | KCNH2 (0.47) | — | |
| SCHEMBL29144357 | 0.77 | TSHR (0.46) | CA2CA1ALDH1A1RARBRARG | |
| Hydrogen Sulfide SCHEMBL27925458 | 0.76 | PTGS2 (0.40) | CA2CA1ALDH1A1HSD17B10PTGS2 | |
| SCHEMBL19323003 | 0.76 | KIF11 (0.44) | PGRKIF11RXRARXRBAR | |
| SCHEMBL31146788 | 0.76 | ALDH1A1 (0.67) | CA2CA1CYP1A2CYP2C9CYP2C19 |
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-4983777-A | Diisopropylbiphenyl mono- and di-hydroperoxides, process for the preparation thereof, and compounds derived therefrom | EASTMAN KODAK COMPANY (US) | 1991-01-08 | — | — | US | disclosed |