Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | POLA1 | P09884 | 1/20 | 0.31 |
| ▸ | POLG | P54098 | 1/20 | 0.31 |
| ▸ | FAP | Q12884 | 1/20 | 0.31 |
| ▸ | SLC22A6 | Q4U2R8 | 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 | |
|---|---|---|---|---|
| SCHEMBL28950834 | 0.85 | NPC1 (0.34) | NPC1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL3561562 | 0.74 | POLB (0.36) | NPC1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL12372630 | 0.73 | DGAT1 (0.38) | — | |
| SCHEMBL14743987 | 0.71 | ABCB11 (0.34) | NPC1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL14737356 | 0.69 | ABCB11 (0.33) | NPC1CYP2C19POLBTDP1ABCB11 | |
| SCHEMBL14738395 | 0.68 | ABCB11 (0.34) | ABCB11POLA1POLGFAPSLC22A6 | |
| SCHEMBL20774171 | 0.67 | P2RX7 (0.49) | TDP1ABCB11POLA1POLGFAP | |
| SCHEMBL31599667 | 0.67 | FGFR1 (0.41) | NPC1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL3730211 | 0.66 | HSP90AB1 (0.49) | — | |
| SCHEMBL28950856 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110117285-B | Inhibitors of influenza virus replication and uses thereof | 广东东阳光药业有限公司 | 2023-02-03 | — | — | CN | disclosed |