Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | STK17B | O94768 | 1/20 | 0.41 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20571809 | 0.92 | TDP1 (0.47) | HTTNPSR1ALDH1A1TDP1STK17B | |
| SCHEMBL17035936 | 0.87 | L3MBTL1 (0.43) | GFERTDP1STK17BSTK17ACA1 | |
| SCHEMBL21743811 | 0.83 | MAOA (0.48) | NPSR1TDP1STK17BSTK17ACA1 | |
| SCHEMBL4385833 | 0.79 | KDM4E (0.42) | HTTNPSR1ALDH1A1MAPT | |
| SCHEMBL6679224 | 0.77 | NPC1 (0.42) | HTTNPSR1ALDH1A1GAAMAPT | |
| Ammonia Solution, Strong SCHEMBL28769647 | 0.77 | MAPK1 (0.35) | NPSR1ALDH1A1GAA | |
| SCHEMBL31569512 | 0.76 | SMN1; SMN2 (0.56) | HTTNPSR1ALDH1A1GFERNQO2 | |
| SCHEMBL28733738 | 0.76 | IDO1 (0.44) | TDP1STK17BSTK17ACA1CA2 | |
| SCHEMBL2083950 | 0.75 | ALDH1A1 (0.50) | HTTNPSR1ALDH1A1GFERTDP1 | |
| SCHEMBL6730949 | 0.75 | SCN9A (0.46) | NPSR1CA1CA2CA9KMT2A |
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-107580595-B | Heterocyclic compounds and their use in the prevention or treatment of bacterial infections | 拜欧蒂姆公司 | 2020-09-18 | — | — | CN | disclosed |