Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.56 |
| ▸ | EGFR | P00533 | 3/20 | 0.54 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.54 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.49 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.49 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.49 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.48 |
| ▸ | PPARD | Q03181 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.48 |
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | THRA | P10827 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL78652 | 0.98 | AKR1B1 (0.58) | AKR1B1EGFRERBB2FFAR1FFAR4 | |
| Hydrochloric Acid SCHEMBL1374336 | 0.96 | AKR1B1 (0.56) | AKR1B1EGFRERBB2FFAR1FFAR4 | |
| SCHEMBL7413003 | 0.85 | SLC7A5 (0.54) | EGFRERBB2FFAR1FFAR4HCAR2 | |
| SCHEMBL1448505 | 0.83 | EGFR (0.53) | EGFRERBB2HCAR2TAAR1 | |
| SCHEMBL70565 | 0.83 | AKR1B1 (0.71) | AKR1B1CYP1A2CYP2C19KDM4ERGS12 | |
| SCHEMBL6669579 | 0.82 | EGFR (0.53) | EGFRERBB2FFAR1FFAR4HCAR2 | |
| SCHEMBL1357383 | 0.82 | EGFR (0.51) | EGFRERBB2HCAR2TAAR1MAPT | |
| SCHEMBL7821970 | 0.81 | FFAR1 (0.48) | AKR1B1EGFRERBB2FFAR1FFAR4 | |
| Hydrochloric Acid SCHEMBL8922940 | 0.81 | AKR1B1 (0.68) | AKR1B1CYP1A2CYP2C19KDM4ERGS12 | |
| SCHEMBL2578166 | 0.80 | MAPK8 (0.52) | EGFRERBB2TAAR1 |
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-0255178-A2 | Process for preparing hetero aryl and aryl alkanoic acids | Nobel Chemicals AB (SE) | 1988-02-03 | — | — | EP | disclosed |