Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.55 |
| ▸ | EGFR | P00533 | 4/20 | 0.54 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.54 |
| ▸ | STAT3 | P40763 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | NSD2 | O96028 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30762254 | 1.00 | TP53 (0.56) | TP53POLBSORT1EGFRPIK3CA | |
| SCHEMBL29176354 | 0.90 | NPC1 (0.58) | TP53POLBEGFRPIK3CANPC1 | |
| SCHEMBL29176363 | 0.85 | NPC1 (0.71) | TP53POLBEGFRPIK3CANPC1 | |
| SCHEMBL29176325 | 0.85 | NHERF1 (0.56) | TP53EGFRPIK3CANPC1RAB9A | |
| SCHEMBL29176334 | 0.85 | NPC1 (0.52) | EGFRPIK3CANPC1RAB9ALMNA | |
| SCHEMBL29176336 | 0.85 | NPC1 (0.52) | TP53POLBEGFRPIK3CANPC1 | |
| SCHEMBL12764054 | 0.84 | EGFR (0.74) | TP53POLBEGFRPIK3CANPC1 | |
| SCHEMBL17422865 | 0.83 | NPC1 (0.57) | EGFRPIK3CANPC1RAB9ALMNA | |
| SCHEMBL30762244 | 0.83 | NPC1 (0.57) | EGFRPIK3CANPC1RAB9ALMNA | |
| SCHEMBL29176360 | 0.81 | RAB9A (0.58) | POLBNPC1RAB9ALMNASMN1; SMN2 |
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-117447381-A | Indole amide derivative and its application in preparing beta 2 Use of adrenoreceptor allosteric antagonist medicaments | 常州大学 | 2024-01-26 | — | — | CN | disclosed |