Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | BTN3A1 | O00481 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18476530 | 1.00 | ITGA4 (0.38) | ITGA4ITGB7ALOX5PTGESMEN1 | |
| SCHEMBL14934170 | 1.00 | ITGA4 (0.38) | ITGA4ITGB7ALOX5PTGESMEN1 | |
| SCHEMBL14934096 | 0.92 | HTT (0.36) | ALDH1A1HTTBTN3A1 | |
| SCHEMBL30583779 | 0.90 | MEN1 (0.42) | ALOX5PTGESMEN1KMT2AALDH1A1 | |
| SCHEMBL16258631 | 0.90 | MEN1 (0.42) | ALOX5PTGESMEN1KMT2AALDH1A1 | |
| SCHEMBL16258629 | 0.90 | MEN1 (0.42) | ALOX5PTGESMEN1KMT2AALDH1A1 | |
| SCHEMBL30511498 | 0.89 | ALOX5 (0.41) | ALOX5PTGESMEN1KMT2AALDH1A1 | |
| SCHEMBL23843999 | 0.89 | ALDH1A1 (0.46) | ITGA4ITGB7MEN1KMT2AALDH1A1 | |
| SCHEMBL18476577 | 0.89 | ALDH1A1 (0.46) | ITGA4ITGB7MEN1KMT2AALDH1A1 | |
| SCHEMBL26276734 | 0.89 | ALDH1A1 (0.46) | ITGA4ITGB7MEN1KMT2AALDH1A1 |
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-2013066991-A1 | CRYSTALLINE SOLVATES OF NUCLEOSIDE PHOSPHOROAMIDATES, THEIR STEREOSELECTIVE PREPARATION, NOVEL INTERMEDIATES THEREOF, AND THEIR USE IN THE TREATMENT OF VIRAL DISEASE | INHIBITEX, INC. (US) | 2013-05-10 | — | — | WO | disclosed |