Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.32 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.32 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL5802587 | 0.83 | NR1H2 (0.34) | NR1H2 | |
| SCHEMBL2229304 | 0.78 | TSHR (0.44) | ALDH1A1TSHRIDO1PDK2CYP2A6 | |
| SCHEMBL29624838 | 0.78 | TSHR (0.44) | ALDH1A1TSHRIDO1PDK2CYP2A6 | |
| SCHEMBL28988428 | 0.76 | NOTUM (0.42) | ALDH1A1TSHRIDO1PDK2CYP2A6 | |
| SCHEMBL7766914 | 0.76 | PDK2 (0.40) | NR1H2ALDH1A1TSHRIDO1PDK2 | |
| SCHEMBL8770312 | 0.75 | NR1H2 (0.42) | NR1H2ALDH1A1TSHRIDO1DNMT1 | |
| SCHEMBL12887892 | 0.75 | NR1H2 (0.42) | NR1H2ALDH1A1TSHRIDO1DNMT1 | |
| SCHEMBL308792 | 0.74 | CYP2A6 (0.52) | NR1H2ALDH1A1TSHRIDO1PDK2 | |
| SCHEMBL11440253 | 0.74 | ALDH1A1 (0.56) | NR1H2ALDH1A1TSHRIDO1DNMT1 | |
| SCHEMBL11618955 | 0.74 | IDO1 (0.54) | NR1H2ALDH1A1TSHRIDO1DNMT1 |
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-4289915-A | Halogenated polyhydroxy compounds and their derivatives | PRODUITS CHIMIQUES UGINE KUHLMANN (FR) | 1981-09-15 | — | — | US | disclosed |