Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | AGER | Q15109 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5749246 | 0.85 | PARP1 (0.60) | ALDH1A1PARP1KDM4E | |
| Water SCHEMBL28396801 | 0.77 | PARP1 (0.68) | ALDH1A1LMNAALOX12HSD17B10PARP1 | |
| SCHEMBL29749881 | 0.74 | PARP1 (0.70) | ALDH1A1LMNAALOX12HSD17B10PARP1 | |
| SCHEMBL111826 | 0.74 | PARP1 (0.70) | ALDH1A1LMNAALOX12HSD17B10PARP1 | |
| SCHEMBL16290019 | 0.73 | PARP1 (0.31) | PARP1 | |
| SCHEMBL30006639 | 0.73 | PARP1 (0.68) | ALDH1A1LMNAALOX12HSD17B10PARP1 | |
| SCHEMBL16859274 | 0.73 | PARP1 (0.68) | ALDH1A1LMNAALOX12HSD17B10PARP1 | |
| Hydrochloric Acid SCHEMBL7320778 | 0.73 | PARP1 (0.68) | ALDH1A1LMNAALOX12HSD17B10PARP1 | |
| SCHEMBL28875211 | 0.73 | PARP1 (0.68) | ALDH1A1LMNAALOX12HSD17B10PARP1 | |
| SCHEMBL31120780 | 0.73 | PARP1 (0.68) | ALDH1A1LMNAALOX12HSD17B10PARP1 |
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-104955332-B | The method of preventing and treating arthropod insect | 住友化学株式会社 | 2017-03-29 | — | — | CN | disclosed |