Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | L3MBTL4 | Q8NA19 | 1/20 | 0.38 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7990406 | 1.00 | ACHE (0.40) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7998464 | 0.86 | ACHE (0.38) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7990258 | 0.86 | ACHE (0.38) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7998889 | 0.85 | L3MBTL4 (0.38) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7989766 | 0.85 | L3MBTL4 (0.38) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7990256 | 0.82 | ACHE (0.42) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7990251 | 0.82 | ACHE (0.42) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7989791 | 0.79 | ACHE (0.42) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL7990260 | 0.79 | ACHE (0.42) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 | |
| SCHEMBL8000126 | 0.79 | ACHE (0.44) | ACHEL3MBTL4L3MBTL3ALDH1A1CYP3A4 |
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-2009117594-A1 | FLUORINATED MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2009-09-24 | — | — | WO | disclosed |