Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 14/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | OGA | O60502 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6839082 | 1.00 | ABCB1 (0.49) | ABCB1NPC1XBP1HTTRAB9A | |
| SCHEMBL6839079 | 1.00 | ABCB1 (0.49) | ABCB1NPC1XBP1HTTRAB9A | |
| SCHEMBL16027313 | 0.95 | ABCB1 (0.48) | ABCB1NPC1XBP1HTTRAB9A | |
| SCHEMBL16027312 | 0.95 | ABCB1 (0.48) | ABCB1NPC1XBP1HTTRAB9A | |
| SCHEMBL13973622 | 0.95 | ABCB1 (0.48) | ABCB1NPC1XBP1HTTRAB9A | |
| SCHEMBL6839119 | 0.91 | ABCB1 (0.47) | ABCB1NPC1XBP1HTTRAB9A | |
| SCHEMBL6839121 | 0.91 | ABCB1 (0.47) | ABCB1NPC1XBP1HTTRAB9A | |
| SCHEMBL20444761 | 0.81 | ABCB1 (0.46) | ABCB1 | |
| SCHEMBL9744999 | 0.79 | ABCB1 (0.40) | ABCB1CYP2D6THRBHSD17B10OGA | |
| SCHEMBL9744773 | 0.79 | ABCB1 (0.40) | ABCB1CYP2D6THRBHSD17B10OGA |
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-2020032152-A1 | STEREOSELECTIVE SYNTHESIS METHOD FOR 4'-SUBSTITUTED NUCLEOSIDE DERIVATIVE | ヤマサ醤油株式会社 | 2020-02-13 | — | — | WO | disclosed |