Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL599315 | 0.84 | — | — | |
| SCHEMBL5485162 | 0.83 | — | — | |
| Toluene SCHEMBL11435719 | 0.80 | ACHE (0.61) | TSHRLMNAALOX12ACHENPC1 | |
| SCHEMBL4328369 | 0.78 | TSHR (0.34) | TSHR | |
| SCHEMBL6037078 | 0.78 | TSHR (0.34) | TSHR | |
| SCHEMBL17082 | 0.78 | — | — | |
| SCHEMBL1928067 | 0.77 | ESR1 (0.31) | — | |
| SCHEMBL5488203 | 0.77 | — | — | |
| SCHEMBL4867196 | 0.77 | ESR1 (0.31) | — | |
| SCHEMBL16401966 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109913596-A | A kind of Leather mildew-proof antibacterial agent and preparation method thereof | 汪逸凡 | 2019-06-21 | — | — | CN | claimed |
| CN-106633782-A | Heat-conductive fluorinated curable composition, cured product thereof, and electric/electronic part | 信越化学工业株式会社 | 2017-05-10 | — | — | CN | disclosed |