Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3724147 | 0.97 | ALDH1A1 (0.36) | ALDH1A1TSHRACLYLMNAHSD17B10 | |
| SCHEMBL29275052 | 0.86 | ACLY (0.36) | ALDH1A1TSHRACLYHSD17B10ACACB | |
| SCHEMBL1114580 | 0.83 | ACLY (0.38) | ALDH1A1TSHRACLYHSD17B10ACACB | |
| SCHEMBL28323669 | 0.81 | AKR1B1 (0.41) | ALDH1A1TSHRACLYHSD17B10ACACB | |
| SCHEMBL18097881 | 0.79 | CES2 (0.44) | ALDH1A1TSHRACLYHSD17B10MEN1 | |
| SCHEMBL5970077 | 0.79 | CES2 (0.44) | ALDH1A1TSHRACLYHSD17B10MEN1 | |
| SCHEMBL7613392 | 0.79 | CES2 (0.44) | ALDH1A1TSHRACLYHSD17B10MEN1 | |
| SCHEMBL5166994 | 0.79 | CES2 (0.44) | ALDH1A1TSHRACLYHSD17B10MEN1 | |
| SCHEMBL8976725 | 0.79 | CES2 (0.44) | ALDH1A1TSHRACLYHSD17B10MEN1 | |
| Ammonia Solution, Strong SCHEMBL28378227 | 0.79 | CES2 (0.39) | ALDH1A1TSHRACLYHSD17B10ACACB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116390995-B | Compounds, uses and methods of preparation thereof | 马夫隆公司 | 2024-08-20 | — | — | CN | disclosed |
| CN-116390995-A | Compounds, uses and methods of preparation thereof | 马夫隆公司 | 2023-07-04 | — | — | CN | disclosed |