Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.34 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.32 |
| ▸ | BCL9 | O00512 | 1/20 | 0.30 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1119103 | 0.85 | — | — | |
| Benzene SCHEMBL27532007 | 0.84 | ALDH1A1 (0.48) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| Ammonia Solution, Strong SCHEMBL28173328 | 0.83 | — | — | |
| SCHEMBL10567055 | 0.83 | — | — | |
| SCHEMBL28044820 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL28202037 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL28470809 | 0.78 | ALDH1A1 (0.52) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL7530721 | 0.74 | CES2 (0.58) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| Butane SCHEMBL7832973 | 0.74 | FFAR3 (0.44) | ALDH1A1FFAR3HDAC3HDAC1HDAC2 | |
| SCHEMBL460009 | 0.73 | — | — |
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-106164247-A | Inoculation microbial inoculum for stress soil | 拜奥菲尔微生物和基因技术及生物化学有限公司 | 2016-11-23 | — | — | CN | disclosed |