Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5733248 | 0.93 | TAAR1 (0.50) | TAAR1HTR2AHMOX1CYP2A6ALDH1A1 | |
| SCHEMBL11402440 | 0.91 | TAAR1 (0.48) | TAAR1HTR2AHMOX1ALDH1A1HPGD | |
| SCHEMBL5645 | 0.87 | TAAR1 (0.59) | TAAR1HTR2ACYP2A6ALDH1A1HPGD | |
| SCHEMBL7904900 | 0.84 | TAAR1 (0.62) | TAAR1HTR2AHMOX1CYP2A6SIGMAR1 | |
| SCHEMBL5238701 | 0.84 | TAAR1 (0.62) | TAAR1HTR2AHMOX1CYP2A6SIGMAR1 | |
| SCHEMBL134452 | 0.81 | TAAR1 (0.59) | TAAR1HTR2AHMOX1CYP2A6ALDH1A1 | |
| SCHEMBL15583726 | 0.81 | TAAR1 (0.59) | TAAR1HTR2AHMOX1CYP2A6ALDH1A1 | |
| SCHEMBL1046459 | 0.80 | TAAR1 (0.52) | TAAR1HTR2AHMOX1CYP2A6SIGMAR1 | |
| SCHEMBL7600636 | 0.80 | ALDH1A1 (0.40) | TAAR1HTR2AALDH1A1HPGDALOX15 | |
| SCHEMBL9479783 | 0.78 | TAAR1 (0.50) | TAAR1HTR2AHMOX1CYP2A6SIGMAR1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112979693-A | Alkyl trimethyl tin compounds, and preparation method and application thereof | 天津师范大学 | 2021-06-18 | — | — | CN | claimed |
| CN-117384079-B | Chiral N-alkyl indole compound and preparation method and application thereof | 云南大学 | 2024-05-24 | — | — | CN | disclosed |
| CN-117384079-A | Chiral N-alkyl indole compound and preparation method and application thereof | 云南大学 | 2024-01-12 | — | — | CN | disclosed |
| CN-112979693-B | Alkyl trimethyl tin compounds, and preparation method and application thereof | 天津师范大学 | 2023-03-28 | — | — | CN | disclosed |
| CN-112979693-A | Alkyl trimethyl tin compounds, and preparation method and application thereof | 天津师范大学 | 2021-06-18 | — | — | CN | disclosed |
| CN-109575063-B | Boron esterification reaction method of alkyl halide without transition metal catalysis | 北京大学 | 2020-06-26 | — | — | CN | disclosed |
| WO-2017082924-A1 | PEPTIDE AND PEPTIDE MIMETIC BINDING ANTAGONISTS OF POLO-LIKE KINASE 1 POLO BOX DOMAIN AND METHODS OF USE | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH & HUMAN SERVICES (US) | 2017-05-18 | — | — | WO | disclosed |