Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 3/20 | 0.58 |
| ▸ | ELANE | P08246 | 1/20 | 0.56 |
| ▸ | PPARG | P37231 | 2/20 | 0.53 |
| ▸ | PPARA | Q07869 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11480519 | 0.94 | HTT (0.60) | HIF1AELANEPPARGPPARARAB9A | |
| SCHEMBL11468430 | 0.85 | CACNA1B (0.51) | HIF1APPARARAB9AHTTLMNA | |
| SCHEMBL2305825 | 0.82 | FFAR1 (0.68) | HIF1AFFAR1FFAR4 | |
| SCHEMBL9479518 | 0.81 | MAPT (0.67) | HIF1AELANERAB9AHTTLMNA | |
| SCHEMBL11464615 | 0.79 | FFAR1 (0.56) | HIF1ARAB9AHTTLMNAFFAR1 | |
| N-Benzylaniline SCHEMBL11480512 | 0.79 | FFAR1 (0.64) | HIF1AHTTFFAR1KMT2AMEN1 | |
| SCHEMBL9799566 | 0.78 | ELANE (0.72) | HIF1AELANERAB9AHTTLMNA | |
| Benzene SCHEMBL28089483 | 0.78 | ELANE (0.72) | HIF1AELANERAB9AHTTLMNA | |
| SCHEMBL45119 | 0.78 | ELANE (0.72) | HIF1AELANERAB9AHTTLMNA | |
| Dimethylamine SCHEMBL29129762 | 0.77 | ELANE (0.66) | HIF1AELANERAB9AHTTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137518-A | As 6 inhibitor of histone deacetylase 1,3,4- oxadiazole derivatives compound and include its pharmaceutical composition | 株式会社钟根堂 | 2018-06-08 | — | — | CN | disclosed |