Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL433293 | 0.93 | — | — | |
| Propionic Acid SCHEMBL21224225 | 0.89 | FFAR3 (0.42) | ALDH1A1TSHRMCL1HSD17B10TDP1 | |
| Acetic Acid SCHEMBL775075 | 0.89 | ALDH1A1 (0.39) | ALDH1A1TSHRMCL1HSD17B10TDP1 | |
| Cyclopentane SCHEMBL29109135 | 0.86 | MCL1 (0.42) | ALDH1A1MCL1KDM4EMEN1MAPT | |
| SCHEMBL774943 | 0.82 | ALDH1A1 (0.35) | ALDH1A1TSHRMEN1MAPTKMT2A | |
| Fluoroacetate SCHEMBL776028 | 0.82 | MCL1 (0.33) | ALDH1A1TSHRMCL1 | |
| Propiolic Acid SCHEMBL29034658 | 0.82 | MCL1 (0.33) | ALDH1A1TSHRMCL1 | |
| Acrylic Acid SCHEMBL25407944 | 0.80 | LMNA (0.37) | ALDH1A1TSHRMCL1HSD17B10TDP1 | |
| Trifluoroacetic Acid SCHEMBL776358 | 0.80 | MCL1 (0.32) | ALDH1A1TSHRMCL1 | |
| SCHEMBL433292 | 0.78 | MCL1 (0.48) | ALDH1A1MCL1KDM4EMEN1MAPT |
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-116848080-A | Compound, composition, electrochemical device, lithium ion secondary battery, and assembly | 大金工业株式会社 | 2023-10-03 | — | — | CN | disclosed |