Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11684738 | 0.88 | ALDH1A1 (0.73) | ALDH1A1CYP3A4TP53THRBTSHR | |
| Propane SCHEMBL11143722 | 0.86 | ALDH1A1 (0.93) | ALDH1A1CYP3A4TP53THRBTSHR | |
| SCHEMBL5098181 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CYP3A4TP53THRBTSHR | |
| SCHEMBL5098171 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CYP3A4TP53THRBTSHR | |
| SCHEMBL2048901 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CYP3A4TP53THRBTSHR | |
| SCHEMBL15617 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CYP3A4TP53THRBTSHR | |
| SCHEMBL4647897 | 0.85 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TP53THRBTSHR | |
| Methacrylic Acid SCHEMBL8653129 | 0.85 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TP53THRBTSHR | |
| Alcohol SCHEMBL875881 | 0.84 | ALDH1A1 (0.89) | ALDH1A1CYP3A4TP53THRBTSHR | |
| Butane SCHEMBL21196517 | 0.84 | ALDH1A1 (0.89) | ALDH1A1CYP3A4TP53THRBTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8242214-B2 | Polymeric sorbents for removing low level contaminants | GEORGIA TECH RESEARCH CORPORATION (US) | 2012-08-14 | — | — | US | disclosed |
| US-20110210073-A1 | POLYMERIC SORBENTS FOR REMOVING LOW LEVEL CONTAMINANTS | GEORGIA TECH RESEARCH CORPORATION (US) | 2011-09-01 | — | — | US | disclosed |