Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 2/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL28724718 | 0.91 | HDAC1 (0.36) | PIK3CDITGB3ITGA2BTRPV1KDM4E | |
| SCHEMBL13209127 | 0.90 | PIK3CD (0.50) | PIK3CDITGB3ITGA2BKDM4EALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL28724720 | 0.83 | EYA2 (0.30) | ITGB3ITGA2BTDP1 | |
| SCHEMBL28724725 | 0.80 | HDAC1 (0.40) | PIK3CDKDM4EALDH1A1POLBTDP1 | |
| SCHEMBL28724721 | 0.77 | PIK3CD (0.39) | PIK3CDTRPV1TDP1L3MBTL1MCHR1 | |
| SCHEMBL1513993 | 0.76 | — | — | |
| SCHEMBL12226508 | 0.75 | PIK3CD (0.50) | PIK3CDKDM4EALDH1A1POLBNPC1 | |
| SCHEMBL21164893 | 0.74 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL4323487 | 0.74 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL2305763 | 0.74 | PIK3CD (0.48) | PIK3CDKDM4EALDH1A1POLBNPC1 |
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-114349748-A | Indazole derivative, preparation method and medical application thereof | 四川海思科制药有限公司 | 2022-04-15 | — | — | CN | disclosed |