Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MGAM | O43451 | 1/20 | 0.48 |
| ▸ | SI | P14410 | 1/20 | 0.48 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL37036 | 0.95 | GAA (0.52) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| SCHEMBL27502689 | 0.95 | GAA (0.52) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| Acetic Acid SCHEMBL31108829 | 0.93 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| Hydrochloric Acid SCHEMBL27549704 | 0.93 | GAA (0.50) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| SCHEMBL29929306 | 0.91 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| Alcohol SCHEMBL28242067 | 0.91 | CYP1A2 (0.48) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| Acetic Acid SCHEMBL28150856 | 0.90 | ALDH1A1 (0.47) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| Acetic Acid Methyl Ester SCHEMBL8524734 | 0.90 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| Ethylene Glycol SCHEMBL28306678 | 0.89 | ALDH1A1 (0.48) | ALDH1A1TSHRCYP1A2GAAMGAM | |
| SCHEMBL6817948 | 0.88 | GAA (0.55) | ALDH1A1TSHRCYP1A2GAAMGAM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0264714-A2 | Selective resin synthesis | Ashland Oil, Inc. (US) | 1988-04-27 | — | — | EP | disclosed |