Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 8/20 | 0.60 |
| ▸ | NPC1 | O15118 | 7/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | BRAF | P15056 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | F2 | P00734 | 1/20 | 0.53 |
| ▸ | TLR4 | O00206 | 1/20 | 0.53 |
| ▸ | TLR2 | O60603 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL19860113 | 0.84 | NPC1 (0.76) | RAB9ANPC1SMN1; SMN2POLBL3MBTL1 | |
| SCHEMBL16996704 | 0.81 | RAB9A (0.66) | SIRT2RAB9ANPC1SMN1; SMN2L3MBTL1 | |
| SCHEMBL8556579 | 0.81 | GRM5 (0.67) | SIRT2RAB9ANPC1SMN1; SMN2POLB | |
| SCHEMBL16654040 | 0.80 | NPC1 (0.60) | RAB9ANPC1BRAFMEN1KMT2A | |
| SCHEMBL10094388 | 0.80 | SIRT2 (0.63) | SIRT2RAB9ANPC1SMN1; SMN2L3MBTL1 | |
| SCHEMBL29366822 | 0.78 | RAB9A (0.89) | RAB9ANPC1SMN1; SMN2L3MBTL1NPSR1 | |
| SCHEMBL997866 | 0.78 | RAB9A (0.89) | RAB9ANPC1SMN1; SMN2L3MBTL1NPSR1 | |
| SCHEMBL19332885 | 0.78 | NPC1 (0.66) | SIRT2RAB9ANPC1SMN1; SMN2L3MBTL1 | |
| SCHEMBL7096171 | 0.78 | RAB9A (0.66) | SIRT2RAB9ANPC1SMN1; SMN2L3MBTL1 | |
| SCHEMBL7348632 | 0.78 | RAB9A (0.66) | SIRT2RAB9ANPC1SMN1; SMN2L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022234965-A1 | HETEROARYL DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT | 주식회사 보로노이 | 2022-11-10 | — | — | WO | disclosed |