Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | HINT1 | P49773 | 3/20 | 0.41 |
| ▸ | PNP | P00491 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TK1 | P04183 | 2/20 | 0.39 |
| ▸ | NT5E | P21589 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | EDNRA | P25101 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | HBB | P68871 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | VCP | P55072 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27875028 | 0.90 | ADORA3 (0.45) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL26130922 | 0.87 | HINT1 (0.41) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL28293070 | 0.84 | ADORA3 (0.41) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL25387706 | 0.81 | HPGD (0.40) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL28250611 | 0.80 | ADORA3 (0.46) | ADORA3MEN1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL28199755 | 0.80 | ADORA3 (0.40) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL5611914 | 0.79 | ADORA3 (0.46) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL14620703 | 0.79 | ADORA3 (0.47) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL18537401 | 0.79 | ADORA3 (0.47) | ADORA3HINT1PNPHPGDTK1 | |
| SCHEMBL13626438 | 0.79 | ADORA3 (0.47) | ADORA3HINT1PNPHPGDTK1 |
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-109661232-A | NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF | 纽约哥伦比亚大学董事会 | 2019-04-19 | — | — | CN | disclosed |