Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17923568 | 0.89 | ALDH1A1 (0.62) | ALDH1A1CYP3A4TP53MGLLCYP2D6 | |
| SCHEMBL94007 | 0.85 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TP53TSHR | |
| SCHEMBL7973778 | 0.84 | ALDH1A1 (0.66) | ALDH1A1CYP3A4TP53MGLLCYP2D6 | |
| SCHEMBL9562767 | 0.83 | ALDH1A1 (0.58) | ALDH1A1CYP3A4TP53 | |
| SCHEMBL11136287 | 0.82 | ALDH1A1 (0.64) | ALDH1A1CYP3A4TP53MGLLCYP2D6 | |
| Acrylonitrile SCHEMBL534109 | 0.82 | ALDH1A1 (0.76) | ALDH1A1CYP3A4TP53MGLLCYP2D6 | |
| SCHEMBL502926 | 0.81 | ALDH1A1 (0.86) | ALDH1A1CYP3A4TP53MGLLCYP2D6 | |
| SCHEMBL908314 | 0.81 | ALDH1A1 (0.86) | ALDH1A1CYP3A4TP53MGLLCYP2D6 | |
| Acrylic Acid SCHEMBL7172352 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP3A4TP53MGLL | |
| SCHEMBL28285678 | 0.80 | ALDH1A1 (0.78) | ALDH1A1CYP3A4TP53MGLLCYP2D6 |
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-5250361-A | Containing copolymer of (meth)acrylonitrile and acrylated ester | RICOH COMPANY LTD. (JP) | 1993-10-05 | — | — | US | disclosed |