Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17237648 | 0.88 | EPHX2 (0.48) | LMNACHEK1 | |
| SCHEMBL10745003 | 0.81 | HPGD (0.53) | LMNACYP2C19MAPTHTTCYP3A4 | |
| SCHEMBL5619654 | 0.80 | CHEK1 (0.52) | MAPTCHEK1 | |
| SCHEMBL28239593 | 0.80 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3CHEK1EGFR | |
| SCHEMBL29086711 | 0.80 | ALDH1A1 (0.50) | HDAC6LMNACYP2C19L3MBTL1MAPT | |
| SCHEMBL16353865 | 0.79 | POLB (0.51) | L3MBTL1MAPTKDM4E | |
| Hydrochloric Acid SCHEMBL28238758 | 0.79 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3CHEK1EGFR | |
| SCHEMBL29086576 | 0.78 | HDAC6 (0.54) | HDAC6LMNACYP2C19L3MBTL1MAPT | |
| SCHEMBL16353608 | 0.77 | ALDH1A1 (0.47) | CYP2C19L3MBTL1MAPTKDM4E | |
| SCHEMBL6508976 | 0.77 | KMT2A (0.67) | CYP2C19MAPTHTTCYP3A4 |
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-104650070-B | Dihydropyrimidines and its application in drug | 广东东阳光药业有限公司 | 2018-09-14 | — | — | CN | disclosed |