Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | EP300 | Q09472 | 2/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.36 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.36 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6605331 | 0.85 | GPR84 (0.40) | CYP1A2ESR1ESR2HSD17B10 | |
| SCHEMBL2496705 | 0.81 | HSP90AA1 (0.42) | CYP1A2PTPN22POLBALOX5USP2 | |
| SCHEMBL6942856 | 0.75 | BACE1 (0.45) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL10670045 | 0.75 | BACE1 (0.45) | ESR1ESR2ALOX5HSD17B1HSD17B2 | |
| SCHEMBL1322927 | 0.74 | TRPM4 (0.41) | TRPM4CYP1A2PTPN22NQO2POLB | |
| SCHEMBL1193247 | 0.74 | TRPM4 (0.41) | TRPM4CYP1A2PTPN22NQO2POLB | |
| SCHEMBL442916 | 0.73 | IDO1 (0.81) | IDO1TRPM4CYP1A2ESR1ESR2 | |
| SCHEMBL13265824 | 0.73 | IDO1 (0.81) | IDO1TRPM4CYP1A2ESR1ESR2 | |
| SCHEMBL7200530 | 0.72 | ESR2 (0.45) | CYP1A2ESR1ESR2ALOX5HSD17B1 | |
| SCHEMBL11504207 | 0.70 | CYP1A2 (0.62) | IDO1TRPM4CYP1A2EP300KAT2B |
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-5122602-A | Optical indicators; medical diagnosis; quantitative analysis; immunoassay | MILES INC. (US) | 1992-06-16 | — | — | US | disclosed |