Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | STS | P08842 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28730832 | 1.00 | CA1 (0.43) | CA1CA9STSTSHRLMNA | |
| SCHEMBL28730837 | 0.98 | CA1 (0.44) | CA1CA9STSTSHRLMNA | |
| SCHEMBL11173078 | 0.98 | CA1 (0.44) | CA1CA9STSTSHRLMNA | |
| SCHEMBL8755163 | 0.91 | CA1 (0.43) | CA1CA9STSTSHRLMNA | |
| SCHEMBL8755171 | 0.91 | CA1 (0.43) | CA1CA9STSTSHRLMNA | |
| SCHEMBL113746 | 0.91 | CA1 (0.43) | CA1CA9STSTSHRLMNA | |
| SCHEMBL10036603 | 0.91 | CA1 (0.43) | CA1CA9STSTSHRLMNA | |
| SCHEMBL3138434 | 0.89 | CA1 (0.37) | CA1CA9STSTSHRMAPT | |
| SCHEMBL11424382 | 0.89 | CA1 (0.37) | CA1CA9STSTSHRMAPT | |
| SCHEMBL1329704 | 0.89 | CA1 (0.37) | CA1CA9STSTSHRMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114409490-B | Method for synthesizing chiral gamma-lactone by one-pot method | 北京师范大学 | 2023-03-14 | — | — | CN | disclosed |
| CN-114409490-A | Method for synthesizing chiral gamma-lactone by one-pot method | 北京师范大学 | 2022-04-29 | — | — | CN | disclosed |
| US-6207862-B1 | PRECURSORS ARE CHIRAL 4-HYDROXYCARBOXAMIDES, 4-HYDROXYHYDROXAMIC ACIDS, OR 4-HYDROXYHYDRAZIDES PRODUCED FROM GAMMA-LACTONES, WHICH IN TURN ARE DERIVED FROM 1,4-DIOLS BY STEREOSELECTIVE OXIDATION, | BIOCATALYTICS, INC. | 2001-03-27 | — | — | US | disclosed |
| WO-1999032649-A1 | METHODS AND PRECURSORS FOR THE PRODUCTION OF CHIRAL 1,3-AMINOALCOHOLS | BIOCATALYTICS, INC. (US) | 1999-07-01 | — | — | WO | disclosed |
| US-4416902-A | Flavoring with cyclohexenyl-beta-methyl acrolein derivatives | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1983-11-22 | — | — | US | disclosed |