Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | CASP3 | P42574 | 3/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | UTRN | P46939 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28695329 | 1.00 | ALDH1A1 (0.43) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL23012747 | 0.88 | MAPT (0.46) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL29479781 | 0.88 | MAPT (0.46) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL28711116 | 0.81 | SMN1; SMN2 (0.59) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL29479777 | 0.81 | SMN1; SMN2 (0.59) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL29479649 | 0.79 | PIK3CA (0.63) | ALDH1A1KDM4ERAB9ARXFP1MEN1 | |
| SCHEMBL23012902 | 0.79 | PIK3CA (0.63) | ALDH1A1KDM4ERAB9ARXFP1MEN1 | |
| SCHEMBL23012175 | 0.78 | NPC1 (0.70) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL29479597 | 0.78 | NPC1 (0.70) | ALDH1A1KDM4ENPC1RAB9APOLB | |
| SCHEMBL23012890 | 0.76 | HDAC6 (0.49) | ALDH1A1KDM4ERAB9ASMN1; SMN2RXFP1 |
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-114269725-A | Anti-influenza virus compound and preparation method and application thereof | 四川海思科制药有限公司 | 2022-04-01 | — | — | CN | disclosed |