Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.69 |
| ▸ | CA2 | P00918 | 3/20 | 0.69 |
| ▸ | CA9 | Q16790 | 3/20 | 0.69 |
| ▸ | CXCR2 | P25025 | 5/20 | 0.65 |
| ▸ | LPL | P06858 | 1/20 | 0.56 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.56 |
| ▸ | MITF | O75030 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | SNCA | P37840 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.49 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL15481246 | 0.87 | CA1 (0.70) | CA1CA2CA9CXCR2RAB9A | |
| SCHEMBL422455 | 0.87 | LPL (0.61) | CA1CA2CA9CXCR2LPL | |
| SCHEMBL257797 | 0.86 | CA1 (0.68) | CA1CA2CA9CXCR2LPL | |
| SCHEMBL14165417 | 0.86 | CA1 (0.68) | CA1CA2CA9CXCR2LPL | |
| SCHEMBL1331266 | 0.84 | CA1 (0.57) | CA1CA2CA9CXCR2RAB9A | |
| SCHEMBL23977713 | 0.84 | CA1 (0.66) | CA1CA2CA9CXCR2RAB9A | |
| SCHEMBL15205206 | 0.84 | CA1 (0.66) | CA1CA2CA9CXCR2LPL | |
| SCHEMBL25984347 | 0.82 | KDM4E (0.56) | CA1CA2CA9CXCR2LPL | |
| SCHEMBL20766995 | 0.81 | CXCR2 (0.49) | CA1CA2CA9CXCR2LPL | |
| SCHEMBL3228174 | 0.81 | CXCR2 (0.55) | CA1CA2CA9CXCR2PTPN1 |
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-110483496-B | Derivative with uracil-benzothiazole structure, preparation method thereof and application of anti-HCV (hepatitis C virus) medicament | 杭州市西溪医院 | 2021-05-04 | — | — | CN | disclosed |