Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | RGS12 | O14924 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22803653 | 0.83 | HSD17B10 (0.39) | ALDH1A1LMNAHSD17B10ADRA2CCHRM2 | |
| SCHEMBL8118811 | 0.76 | HDAC1 (0.56) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL24757742 | 0.75 | HDAC3 (0.61) | ALDH1A1LMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL25668354 | 0.71 | CYP3A4 (0.49) | CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL9806266 | 0.70 | HPGD (0.48) | ALDH1A1LMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL12197839 | 0.70 | NPSR1 (0.45) | ALDH1A1LMNAHSD17B10ADRA2CCHRM2 | |
| SCHEMBL22959429 | 0.69 | SLC6A2 (0.48) | ALDH1A1LMNAHSD17B10CYP3A4CYP2C19 | |
| SCHEMBL8697335 | 0.69 | TDP1 (0.48) | LMNAHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL22959426 | 0.68 | CNR1 (0.56) | ALDH1A1LMNAHDAC3HDAC4HDAC1 | |
| SCHEMBL10710110 | 0.68 | HSD17B10 (0.52) | ALDH1A1LMNAHDAC3HDAC4HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021022932-A1 | α-SUBSTITUTED PHENYL STRUCTURE-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR, AND DISINFECTANT | 郑州大学 | 2021-02-11 | — | — | WO | disclosed |