Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HPRT1 | P00492 | 8/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | VCP | P55072 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TK1 | P04183 | 1/20 | 0.39 |
| ▸ | PNP | P00491 | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL15046000 | 0.89 | GAA (0.42) | GAAKMT2AHPRT1BLMMEN1 | |
| SCHEMBL769982 | 0.88 | GAA (0.47) | GAAKMT2AHPRT1BLMMEN1 | |
| Penciclovir SCHEMBL3494 | 0.88 | TK1 (0.49) | GAAKMT2AHPRT1BLMMEN1 | |
| SCHEMBL15257623 | 0.88 | KMT2A (0.42) | GAAKMT2AHPRT1BLMMEN1 | |
| Penciclovir SCHEMBL454089 | 0.84 | HPRT1 (0.47) | KMT2AHPRT1BLMMEN1ALDH1A1 | |
| SCHEMBL133681 | 0.84 | TK1 (0.43) | GAAKMT2AHPRT1BLMMEN1 | |
| Penciclovir SCHEMBL4240103 | 0.84 | HPRT1 (0.47) | KMT2AHPRT1BLMMEN1ALDH1A1 | |
| Water SCHEMBL15532449 | 0.83 | TK1 (0.42) | GAAKMT2AHPRT1BLMMEN1 | |
| Penciclovir SCHEMBL5171433 | 0.79 | PNP (0.70) | KMT2AHPRT1BLMMEN1ALDH1A1 | |
| Penciclovir SCHEMBL15568622 | 0.78 | HPRT1 (0.42) | KMT2AHPRT1BLMMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013090420-A2 | FATTY ACID ANTIVIRAL CONJUGATES AND THEIR USES | CATABASIS PHARMACEUTICALS, INC. (US) | 2013-06-20 | — | — | WO | disclosed |