Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1538377 | 0.97 | ALDH1A1 (0.37) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL22841107 | 0.92 | ALDH1A1 (0.34) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL10615792 | 0.92 | ALDH1A1 (0.34) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL15907967 | 0.92 | ALDH1A1 (0.37) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL15907956 | 0.89 | ALDH1A1 (0.36) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL15907968 | 0.89 | ALDH1A1 (0.36) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL16855771 | 0.84 | FDPS (0.43) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL1758664 | 0.82 | FDPS (0.41) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL9767572 | 0.81 | FDPS (0.45) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| Ammonia Solution, Strong SCHEMBL29057973 | 0.80 | ALDH1A1 (0.36) | ALDH1A1LMNACYP3A4ALOX15TSHR |
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-105327689-A | Preparation and applications of molecular sieve gasoline desulfurizing agent loaded with functionalized ionic liquid | UNIV SOUTH CHINA TECH | 2016-02-17 | — | — | CN | disclosed |