Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.80 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | STAT1 | P42224 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 3/20 | 0.42 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.42 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.42 |
| ▸ | ITGAL | P20701 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30894572 | 0.89 | RXRA (0.66) | RXRAEGFRRAB9ANPC1MCHR1 | |
| SCHEMBL30894581 | 0.89 | RXRA (0.65) | RXRAEGFRRAB9ANPC1MCHR1 | |
| SCHEMBL30894571 | 0.87 | RXRA (0.72) | RXRAEGFRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL30894574 | 0.86 | RXRA (0.61) | RXRAEGFRRAB9ANPC1MCHR1 | |
| SCHEMBL30894568 | 0.82 | RXRA (0.66) | RXRAEGFRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL30366881 | 0.81 | RXRA (0.85) | RXRARAB9ANPC1DEGS1SMN1; SMN2 | |
| SCHEMBL30894589 | 0.81 | RXRA (0.64) | RXRAEGFRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL30366946 | 0.80 | RXRA (0.82) | RXRAEGFRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL30367547 | 0.80 | RXRA (0.82) | RXRARAB9ANPC1SMN1; SMN2DHODH | |
| SCHEMBL30894563 | 0.79 | EGFR (0.61) | RXRAEGFRRAB9ANPC1DEGS1 |
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-117645568-A | N- ([ 4,4' -bipyridine ] -2-yl) cinnamamide derivative, and preparation and application thereof | 厦门大学 | 2024-03-05 | — | — | CN | disclosed |