Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | TSHR | P16473 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 3/20 | 0.32 |
| ▸ | CES1 | P23141 | 2/20 | 0.32 |
| ▸ | ANPEP | P15144 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | SMPD1 | P17405 | 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 | |
|---|---|---|---|---|
| Tert-Butyl Hydroperoxide SCHEMBL27266819 | 0.93 | ALDH1A1 (0.60) | ALDH1A1TSHRLMNATHRBSMN1; SMN2 | |
| Nonane SCHEMBL10465898 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TSHRLMNATHRBSMN1; SMN2 | |
| Decane SCHEMBL503047 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TSHRLMNATHRBSMN1; SMN2 | |
| Octane SCHEMBL5960977 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TSHRLMNATHRBSMN1; SMN2 | |
| Hexadecane SCHEMBL16712179 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TSHRLMNATHRBSMN1; SMN2 | |
| Tert-Butyl Hydroperoxide SCHEMBL27389585 | 0.86 | ALDH1A1 (0.69) | ALDH1A1TSHR | |
| Tert-Butyl Hydroperoxide SCHEMBL8125721 | 0.85 | ALDH1A1 (0.61) | ALDH1A1TSHRLMNATHRBSMN1; SMN2 | |
| Tert-Butyl Hydroperoxide SCHEMBL11619371 | 0.83 | ALDH1A1 (0.47) | ALDH1A1TSHRLMNATHRBMEN1 | |
| Tert-Butyl Hydroperoxide SCHEMBL8131481 | 0.83 | ALDH1A1 (0.47) | ALDH1A1TSHRLMNATHRBMEN1 | |
| Tert-Butyl Hydroperoxide SCHEMBL788774 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHR |
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-108699400-A | The solidification of anaerobism composition | 汉高知识产权控股有限责任公司 | 2018-10-23 | — | — | CN | disclosed |