Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 11/20 | 0.67 |
| ▸ | NPC1 | O15118 | 10/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.67 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.67 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.67 |
| ▸ | RELA | Q04206 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | HTT | P42858 | 3/20 | 0.63 |
| ▸ | GAA | P10253 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.63 |
| ▸ | ESRRG | P62508 | 1/20 | 0.57 |
| ▸ | LY96 | Q9Y6Y9 | 1/20 | 0.56 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | PLAU | P00749 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29669668 | 1.00 | RAB9A (0.67) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL28256407 | 0.82 | RAB9A (0.76) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL29669746 | 0.82 | RAB9A (0.76) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL3331071 | 0.78 | RAB9A (0.74) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL12044291 | 0.77 | NPC1 (0.57) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL3069128 | 0.76 | RAB9A (0.71) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL3058851 | 0.76 | KMT2A (0.69) | RAB9ANPC1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL8460943 | 0.76 | RAB9A (0.75) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL3680858 | 0.76 | KMT2A (0.71) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL20078361 | 0.76 | RAB9A (0.83) | RAB9ANPC1SMN1; SMN2NFKB1NFKB2 |
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-108863892-B | Gallic acid methyl ester analogue containing amide structure and application thereof | 温州医科大学 | 2022-04-05 | — | — | CN | disclosed |
| CN-108863892-A | A kind of gallicin analog of amide containing structure and application | 温州医科大学 | 2018-11-23 | — | — | CN | disclosed |