Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28179953 | 0.82 | SLC6A2 (0.39) | TAAR1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL28851782 | 0.82 | IDO1 (0.41) | TAAR1TSHRALDH1A1CYP2D6LMNA | |
| SCHEMBL28175616 | 0.81 | SLC6A4 (0.43) | TAAR1SLC6A4TSHRALDH1A1CYP2D6 | |
| SCHEMBL28179094 | 0.80 | PNMT (0.46) | TAAR1TSHRHPGD | |
| SCHEMBL28174626 | 0.79 | TAAR1 (0.50) | TAAR1SIGMAR1 | |
| SCHEMBL28179951 | 0.77 | TAAR1 (0.35) | TAAR1TSHRALDH1A1 | |
| SCHEMBL28179948 | 0.77 | DPP4 (0.40) | — | |
| SCHEMBL29022757 | 0.77 | SIGMAR1 (0.47) | TAAR1SIGMAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL28174653 | 0.75 | IDO1 (0.41) | TAAR1SIGMAR1ALDH1A1LMNAHPGD | |
| SCHEMBL15949871 | 0.75 | ALDH1A1 (0.41) | TAAR1SLC6A2TSHRALDH1A1HPGD |
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-107226822-A | A kind of preparation method of hexa-atomic silaoxacyclen | 杭州师范大学 | 2017-10-03 | — | — | CN | disclosed |