Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.62 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.39 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17987904 | 1.00 | MAPT (0.62) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL7460311 | 0.97 | — | — | |
| SCHEMBL393724 | 0.81 | MAPT (0.58) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL8585201 | 0.81 | MAPT (0.58) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL9007405 | 0.81 | MAPT (0.58) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL9007415 | 0.81 | MAPT (0.58) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL18585414 | 0.81 | MAPT (0.58) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL8609151 | 0.81 | MAPT (0.58) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL17178094 | 0.80 | TSHR (0.41) | MAPTABCC4ALDH1A1LMNATSHR | |
| SCHEMBL6151574 | 0.77 | — | — |
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-2014145507-A1 | A PROCESS FOR MAKING A 4-AMINO-4-OXOBUTANOYL PEPTIDE CYCLIC ANALOGUE, AN INHIBITOR OF VIRAL REPLICATION, AND INTERMEDIATES THEREOF | ACHILLION PHARMACEUTICALS, INC. (US) | 2014-09-18 | — | — | WO | disclosed |