Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 6/20 | 0.32 |
| ▸ | CA1 | P00915 | 6/20 | 0.32 |
| ▸ | CA9 | Q16790 | 6/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.30 |
| ▸ | P2RY4 | P51582 | 1/20 | 0.30 |
| ▸ | P2RY14 | Q15391 | 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 | |
|---|---|---|---|---|
| SCHEMBL25712624 | 0.79 | P2RY2 (0.37) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL12111813 | 0.78 | THRB (0.49) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL25719257 | 0.77 | FBP1 (0.34) | P2RY2P2RY4P2RY14 | |
| SCHEMBL11923052 | 0.76 | FBP1 (0.44) | P2RY2P2RY4P2RY14 | |
| SCHEMBL25719140 | 0.76 | P2RY14 (0.33) | P2RY2P2RY4P2RY14 | |
| SCHEMBL6973818 | 0.70 | CYP2D6 (0.42) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL22592286 | 0.68 | THRB (0.57) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL16358235 | 0.68 | THRB (0.57) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL22516447 | 0.68 | THRB (0.57) | CA2CYP2D6THRBHSD17B10TSHR | |
| SCHEMBL20711502 | 0.68 | THRB (0.57) | CA2CYP2D6THRBHSD17B10TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3131914-B1 | 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV | IDENIX PHARMACEUTICALS LLC (US) | 2023-05-10 | — | — | EP | disclosed |