Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | WHR1 | P49842 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4055295 | 0.80 | ALDH1A1 (0.43) | CYP1A2TDP1KDM1AALDH1A1HSD17B10 | |
| SCHEMBL31055044 | 0.79 | HTT (0.44) | CYP1A2ALDH1A1HSD17B10CYP2D6MAPT | |
| SCHEMBL31587567 | 0.77 | MEN1 (0.45) | TDP1ALDH1A1MAPTL3MBTL1SMN1; SMN2 | |
| SCHEMBL1752645 | 0.76 | KDM1A (0.50) | CYP1A2TDP1KDM1AALDH1A1HSD17B10 | |
| SCHEMBL1829575 | 0.76 | KDM1A (0.46) | CYP1A2TDP1KDM1AALDH1A1HSD17B10 | |
| SCHEMBL30997646 | 0.76 | TSHR (0.49) | CYP1A2CYP2D6TSHRMAPK1SMN1; SMN2 | |
| SCHEMBL30997647 | 0.76 | TSHR (0.49) | CYP1A2CYP2D6TSHRMAPK1SMN1; SMN2 | |
| SCHEMBL17911056 | 0.74 | KDM1A (0.53) | CYP1A2TDP1KDM1AALDH1A1CTSD | |
| SCHEMBL7627201 | 0.74 | KDM1A (0.53) | CYP1A2TDP1KDM1AALDH1A1CTSD | |
| SCHEMBL73610 | 0.74 | KDM1A (0.53) | CYP1A2TDP1KDM1AALDH1A1CTSD |
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-118459440-A | Preparation method and application of tetra-substituted aryl compound | 江苏普莱医药生物技术有限公司 | 2024-08-09 | — | — | CN | disclosed |