Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 3/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.42 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydroquinone SCHEMBL6750226 | 0.87 | HSD17B10 (0.46) | CA1CA2TAAR1SLC6A2ESR1 | |
| SCHEMBL8301664 | 0.85 | TAAR1 (0.47) | CA1CA2TAAR1SLC6A2IDO1 | |
| SCHEMBL2405469 | 0.84 | IDO1 (0.45) | CA1CA2IDO1CA7CA9 | |
| SCHEMBL10973793 | 0.84 | HTT (0.57) | CA1CA2SLC6A2IDO1CA9 | |
| SCHEMBL28775048 | 0.84 | CYP3A4 (0.45) | CA1CA2IDO1CA7CA9 | |
| SCHEMBL2405472 | 0.84 | IDO1 (0.45) | CA1CA2IDO1CA7CA9 | |
| SCHEMBL873616 | 0.83 | CA1 (0.61) | CA1CA2CA7CA9HTT | |
| SCHEMBL1096291 | 0.83 | CA1 (0.61) | CA1CA2CA7CA9HTT | |
| SCHEMBL12172311 | 0.83 | HSD17B10 (0.50) | CA1CA2IDO1CA7CA9 | |
| SCHEMBL2181772 | 0.83 | CA1 (0.61) | CA1CA2CA7CA9HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001009072-A1 | PROCESS FOR THE PRODUCTION OF HYDROXY-SUBSTITUTED AROMATIC ALDEHYDES AND KETONES | PORT ELIZABETH TECHNIKON (ZA) | 2001-02-08 | — | — | WO | disclosed |