Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | BACE1 | P56817 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.49 |
| ▸ | ABAT | P80404 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29479746 | 0.92 | GPR35 (0.67) | GPR35NPSR1RXFP1BACE1MAPT | |
| SCHEMBL68980 | 0.92 | GPR35 (0.67) | GPR35NPSR1RXFP1BACE1MAPT | |
| Hydrochloric Acid SCHEMBL27548476 | 0.90 | GPR35 (0.64) | GPR35NPSR1RXFP1BACE1MAPT | |
| Methoxymethane SCHEMBL11671269 | 0.85 | GPR35 (0.58) | GPR35NPSR1RXFP1BACE1MAPT | |
| Acetic Acid SCHEMBL9635583 | 0.83 | GPR35 (0.56) | GPR35NPSR1RXFP1BACE1MAPT | |
| Acetic Acid SCHEMBL9635628 | 0.83 | GPR35 (0.56) | GPR35NPSR1RXFP1BACE1MAPT | |
| SCHEMBL10920082 | 0.81 | GPR35 (0.55) | GPR35NPSR1RXFP1BACE1MAPT | |
| SCHEMBL9499320 | 0.80 | GPR35 (0.62) | GPR35NPSR1RXFP1BACE1MAPT | |
| SCHEMBL213758 | 0.77 | TSHR (0.56) | GPR35NPSR1RXFP1BACE1HPGD | |
| SCHEMBL29577003 | 0.77 | TSHR (0.56) | GPR35NPSR1RXFP1BACE1HPGD |
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-110156739-A | The preparation method of 1,3,5,8- tetrahydroxy xanthone and 1,3,7,8- tetrahydroxy xanthone | 广州药本君安医药科技股份有限公司 | 2019-08-23 | — | — | CN | disclosed |