Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL12944479 | 0.85 | MEN1 (0.50) | TSHRMEN1KMT2AL3MBTL1CYP2C19 | |
| SCHEMBL12944476 | 0.85 | MEN1 (0.50) | TSHRMEN1KMT2AL3MBTL1CYP2C19 | |
| SCHEMBL531471 | 0.85 | MEN1 (0.50) | TSHRMEN1KMT2AL3MBTL1CYP2C19 | |
| Propylene Oxide SCHEMBL335355 | 0.82 | TSHR (0.62) | TSHRMEN1KMT2AL3MBTL1CYP2C19 | |
| Propylene Oxide SCHEMBL335357 | 0.82 | TSHR (0.62) | TSHRMEN1KMT2AL3MBTL1CYP2C19 | |
| SCHEMBL11329778 | 0.76 | CYP11B1 (0.40) | TSHRMEN1KMT2AL3MBTL1CYP2C19 | |
| SCHEMBL12677784 | 0.75 | TAAR1 (0.46) | TSHRMEN1KMT2ACYP2C19TAAR1 | |
| SCHEMBL5100543 | 0.73 | SLC6A2 (0.46) | TSHRL3MBTL1TAAR1LMNA | |
| SCHEMBL14747307 | 0.73 | SLC6A2 (0.46) | TSHRL3MBTL1TAAR1LMNA | |
| SCHEMBL7720184 | 0.73 | BCHE (0.49) | MEN1KMT2AL3MBTL1 |
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-108601958-A | Pro-perfume compositions | 爱客多有限公司 | 2018-09-28 | — | — | CN | disclosed |