Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 3/20 | 0.34 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.34 |
| ▸ | FEN1 | P39748 | 2/20 | 0.34 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL3835986 | 0.93 | CFTR (0.35) | NPSR1CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL13646991 | 0.81 | ALDH1A1 (0.44) | NPSR1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL3835981 | 0.80 | CFTR (0.32) | NPSR1CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL3835976 | 0.80 | CFTR (0.32) | NPSR1CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL3838223 | 0.78 | ATR (0.37) | NPSR1CYP2A6 | |
| SCHEMBL1483613 | 0.73 | GAA (0.36) | NPSR1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL13647158 | 0.72 | LMNA (0.39) | KDM4EALDH1A1SMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL23467921 | 0.71 | ERCC1 (0.56) | NPSR1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL13646998 | 0.71 | — | — | |
| SCHEMBL13647264 | 0.70 | ALDH1A1 (0.41) | NPSR1KDM4EALDH1A1SMN1; SMN2GAA |
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-1309566-B1 | DIHYDROXYPYRIMIDINE CARBOXYLIC ACIDS AS VIRAL POLYMERASE INHIBITORS | ANGELETTI P IST RICHERCHE BIO (IT) | 2009-10-07 | — | — | EP | disclosed |