Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX4 | Q99571 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL15413770 | 0.72 | P2RX4 (0.40) | P2RX4CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL6025176 | 0.69 | ALDH1A1 (0.35) | P2RX4TSHRALDH1A1CA1CA2 | |
| SCHEMBL12776605 | 0.65 | P2RX4 (0.49) | P2RX4CYP2A6TSHRALDH1A1HSD17B10 | |
| SCHEMBL11221810 | 0.62 | CA1 (0.33) | CYP2A6TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL29442976 | 0.61 | ALDH1A1 (0.44) | CYP2A6TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL4623560 | 0.61 | ALDH1A1 (0.44) | CYP2A6TSHRALDH1A1HSD17B10TDP1 | |
| Lithium SCHEMBL29767624 | 0.60 | ALDH1A1 (0.42) | CYP2A6TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL51496 | 0.59 | ALDH1A1 (0.41) | CYP2A6TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL5503788 | 0.59 | ALDH1A1 (0.41) | CYP2A6TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL3065330 | 0.59 | ALDH1A1 (0.41) | P2RX4CYP2A6TSHRALDH1A1HSD17B10 |
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-120028308-A | Small molecule Raman probe, bar code probe, encoding method and application thereof | 北京大学 | 2025-05-23 | — | — | CN | claimed |