Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | IGF1R | P08069 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31146807 | 0.85 | ABL1 (0.39) | CNR2ABL1SRCIDO1PARK7 | |
| SCHEMBL8875932 | 0.83 | ALDH1A1 (0.45) | CNR2PPARGPPARAALDH1A1TACR1 | |
| SCHEMBL31146803 | 0.77 | ALDH1A1 (0.48) | IDO1ALDH1A1ALOX5AP | |
| SCHEMBL31146817 | 0.77 | HTR2A (0.47) | CNR2IGF1R | |
| SCHEMBL3042346 | 0.74 | SRD5A2 (0.50) | TAAR1IDO1KDM4EALDH1A1 | |
| SCHEMBL8909 | 0.73 | TRPV1 (0.50) | TAAR1ALDH1A1 | |
| SCHEMBL21085616 | 0.72 | BACE1 (0.47) | TAAR1CNR2IDO1PPARGPPARA | |
| SCHEMBL1729090 | 0.71 | TRPV1 (0.48) | TAAR1ALDH1A1 | |
| SCHEMBL23040246 | 0.71 | PDE2A (0.46) | TAAR1CNR2ALDH1A1 | |
| SCHEMBL2329086 | 0.71 | ALDH1A1 (0.47) | TAAR1IDO1PPARGPPARAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-118724934-A | Mechanochemical synthesis of alpha-haloalkylboron esters | 西安交通大学 | 2024-10-01 | — | — | CN | disclosed |