Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1988589 | 0.78 | TAAR1 (0.48) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL6085811 | 0.76 | TAAR1 (0.46) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL29767673 | 0.76 | TAAR1 (0.46) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL1610053 | 0.76 | TAAR1 (0.46) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL87998 | 0.76 | GABRA1 (0.47) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL168282 | 0.76 | TAAR1 (0.46) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL7572072 | 0.74 | GABRA1 (0.45) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL16167522 | 0.74 | TAAR1 (0.56) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL16681697 | 0.74 | GABRA1 (0.45) | TAAR1ACHETSHRCHRM2PTGS1 | |
| SCHEMBL1276610 | 0.74 | TAAR1 (0.56) | TAAR1ACHETSHRCHRM2PTGS1 |
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-114956933-A | Marker containing isotope oxygen atom and preparation method and application thereof | 清华大学 | 2022-08-30 | — | — | CN | disclosed |