Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.49 |
| ▸ | CES1 | P23141 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL29291328 | 0.91 | LMNA (0.52) | LMNACES2CES1L3MBTL1ALDH1A1 | |
| SCHEMBL29291326 | 0.91 | NPC1 (0.51) | LMNACES2CES1ALDH1A1CYP3A4 | |
| SCHEMBL29291333 | 0.90 | LMNA (0.50) | LMNACES2CES1ALDH1A1CYP3A4 | |
| SCHEMBL29291325 | 0.87 | SMN1; SMN2 (0.46) | LMNAALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29291338 | 0.87 | ALDH1A1 (0.50) | LMNACES2CES1L3MBTL1ALDH1A1 | |
| SCHEMBL29291323 | 0.87 | CES2 (0.49) | LMNACES2CES1CYP3A4HDAC1 | |
| SCHEMBL29291340 | 0.85 | CES2 (0.46) | LMNACES2CES1TDP1ALDH1A1 | |
| SCHEMBL29291324 | 0.81 | ALDH1A1 (0.55) | LMNATDP1L3MBTL1ALDH1A1CYP3A4 | |
| SCHEMBL29291330 | 0.81 | GPR139 (0.44) | LMNACES2CES1ALDH1A1HPGD | |
| SCHEMBL28770630 | 0.79 | L3MBTL1 (0.45) | LMNACES2CES1TDP1L3MBTL1 |
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-109761842-B | Synthesis method of alpha-F-beta-NHAc-carbonyl compound | 浙江工业大学 | 2021-11-30 | — | — | CN | disclosed |