Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | AGXT | P21549 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL28851766 | 0.82 | TAAR1 (0.35) | SLC6A2SLC6A3SLC6A4CYP2D6ALDH1A1 | |
| SCHEMBL28851782 | 0.72 | IDO1 (0.41) | IDO1CYP2D6ALDH1A1TAAR1LMNA | |
| SCHEMBL938705 | 0.63 | TAAR1 (0.43) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL1479279 | 0.61 | IDO1 (0.48) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL7338557 | 0.61 | IDO1 (0.42) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL320387 | 0.61 | TAAR1 (0.41) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL764989 | 0.60 | SLC6A2 (0.67) | SLC6A2SLC6A3SLC6A4HTR2AIDO1 | |
| SCHEMBL9005207 | 0.60 | SLC6A2 (0.48) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL29022757 | 0.59 | SIGMAR1 (0.47) | SLC6A2SLC6A3SLC6A4HTR2ACYP2D6 | |
| SCHEMBL10819594 | 0.59 | IDO1 (0.52) | SLC6A2SLC6A3SLC6A4CHRNA4IDO1 |
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 |