Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL9447535 | 0.84 | CYP2C9 (0.50) | CYP2C9LMNAHTTL3MBTL1HIF1A | |
| SCHEMBL8727229 | 0.83 | CYP2C9 (0.42) | CYP2C9LMNAHTTL3MBTL1HIF1A | |
| SCHEMBL5709851 | 0.83 | BID (0.47) | — | |
| SCHEMBL6924319 | 0.82 | CYP2C9 (0.42) | CYP2C9LMNAL3MBTL1HIF1ACYP2D6 | |
| SCHEMBL11014631 | 0.81 | POLB (0.48) | LMNAHTTL3MBTL1CYP2D6CHRM2 | |
| SCHEMBL8134336 | 0.81 | SMN1; SMN2 (0.44) | CYP2C9LMNAHIF1ACYP2D6CHRM2 | |
| Benzylic Acid SCHEMBL7066 | 0.80 | CYP2C9 (0.74) | CYP2C9LMNAHTTL3MBTL1HIF1A | |
| SCHEMBL30335199 | 0.80 | KCNN4 (0.44) | HIF1ACYP2D6ALDH1A1KMT2AMAPT | |
| SCHEMBL11567881 | 0.80 | CYP2C9 (0.40) | CYP2C9LMNAHTTL3MBTL1HIF1A | |
| SCHEMBL20263105 | 0.79 | GABRA1 (0.45) | CYP2C9LMNAHTTL3MBTL1HIF1A |
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-103613502-B | 1,1-phenylbenzene-1-hydroxyl ethyl acetate preparation method | WUHAN EASTIN CHEMICAL INDUSTRY CO., LTD. (CN) | 2016-01-06 | — | — | CN | disclosed |