Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | AGXT | P21549 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL28659472 | 0.80 | TAAR1 (0.47) | TAAR1IDO1ALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL28669826 | 0.79 | TDP1 (0.48) | CYP2A6TAAR1KCNH2ALOX15SMN1; SMN2 | |
| SCHEMBL14078071 | 0.78 | CYP1A2 (0.45) | CYP1A2CYP2A6TAAR1IDO1HRH3 | |
| SCHEMBL28660275 | 0.77 | CYP11B1 (0.33) | ALDH1A1MEN1KMT2A | |
| SCHEMBL28660351 | 0.77 | KCNH2 (0.46) | KCNH2NPC1RAB9A | |
| SCHEMBL16335308 | 0.77 | TAAR1 (0.53) | TAAR1IDO1SMN1; SMN2KMT2A | |
| SCHEMBL28659125 | 0.77 | TAAR1 (0.53) | TAAR1IDO1KCNH2 | |
| SCHEMBL24602755 | 0.76 | CYP1A2 (0.52) | CYP1A2CYP2A6TAAR1IDO1HRH3 | |
| SCHEMBL988079 | 0.76 | IDO1 (0.44) | CYP1A2CYP2A6TAAR1IDO1HRH3 | |
| SCHEMBL28672310 | 0.75 | TAAR1 (0.55) | TAAR1IDO1HRH3ACHE |
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-113717209-A | Synthesis method of alkyl silicon compound | 南通大学 | 2021-11-30 | — | — | CN | disclosed |