Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.66 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | BUB1 | O43683 | 1/20 | 0.45 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.45 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.45 |
| ▸ | ITGAL | P20701 | 2/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.44 |
| ▸ | WNT1 | P04628 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30367096 | 0.82 | RXRA (0.61) | RXRARAB9AITGB2ICAM1ITGAL | |
| SCHEMBL30366740 | 0.82 | RXRA (0.58) | RXRAITGB2ICAM1ITGALMAPK14 | |
| SCHEMBL30366865 | 0.80 | RXRA (0.56) | RXRATSHRITGB2ICAM1ITGAL | |
| SCHEMBL30576086 | 0.78 | GSK3B (0.49) | RXRASMN1; SMN2ALDH1A1KDM4ETSHR | |
| SCHEMBL29083757 | 0.76 | RXRA (0.60) | RXRARAB9ASMN1; SMN2ALDH1A1ITGB2 | |
| SCHEMBL30367152 | 0.75 | WNT3A (0.54) | RXRAWNT3A | |
| SCHEMBL30366978 | 0.75 | WNT3A (0.56) | RXRAWNT3A | |
| SCHEMBL29083767 | 0.74 | RXRA (0.58) | RXRARAB9ANPC1ALDH1A1KDM4E | |
| SCHEMBL31050200 | 0.73 | WNT3A (0.57) | RXRATSHRITGB2ICAM1ITGAL | |
| SCHEMBL3491650 | 0.70 | RAB9A (0.61) | RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-116082310-B | Bipyridine amide derivative, and preparation and application thereof | 厦门大学 | 2024-08-20 | — | — | CN | disclosed |
| CN-116082310-A | Bipyridine amide derivative, and preparation and application thereof | 厦门大学 | 2023-05-09 | — | — | CN | disclosed |