Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL20924690 | 0.85 | ABCB11 (0.41) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL23386387 | 0.85 | ABCB11 (0.41) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL21183638 | 0.85 | ALDH1A1 (0.41) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL21185018 | 0.84 | ALDH1A1 (0.34) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL18796426 | 0.76 | ALDH1A1 (0.41) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL15135171 | 0.75 | GAA (0.38) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL22261510 | 0.74 | ALDH1A1 (0.39) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL22261517 | 0.74 | ALDH1A1 (0.39) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL22508465 | 0.74 | ALDH1A1 (0.46) | ALDH1A1GAAMAPTHPGDALOX12 | |
| SCHEMBL21185009 | 0.72 | HDAC9 (0.31) | ALDH1A1MAPTHPGDALOX12TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020205835-A1 | FUSED POLYCYCLIC PYRIDONE COMPOUNDS AS INFLUENZA VIRUS REPLICATION INHIBITORS | NIKANG THERAPEUTICS, INC. (US) | 2020-10-08 | — | — | WO | disclosed |
| WO-2020205832-A1 | FUSED POLYCYCLIC PYRIDONE COMPOUNDS AS INFLUENZA VIRUS REPLICATION INHIBITORS | NIKANG THERAPEUTICS, INC. (US) | 2020-10-08 | — | — | WO | disclosed |