Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 10/20 | 0.76 |
| ▸ | KCNK9 | Q9NPC2 | 7/20 | 0.76 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.67 |
| ▸ | RAB9A | P51151 | 4/20 | 0.65 |
| ▸ | NPC1 | O15118 | 3/20 | 0.65 |
| ▸ | HPGD | P15428 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.63 |
| ▸ | MEN1 | O00255 | 4/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 2/20 | 0.61 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL6530432 | 1.00 | KCNK3 (0.76) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL3673898 | 0.91 | KCNK3 (0.61) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL18410447 | 0.89 | HDAC1 (0.67) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL5455627 | 0.87 | NPC1 (0.70) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL2298254 | 0.87 | KCNK3 (1.00) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL27835354 | 0.86 | NQO2 (0.59) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL25872216 | 0.85 | KCNK3 (0.62) | KCNK3KCNK9RAB9ANPC1KMT2A | |
| SCHEMBL14715827 | 0.83 | KCNK3 (0.92) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL14715912 | 0.83 | KCNK3 (0.92) | KCNK3KCNK9SIRT1RAB9ANPC1 | |
| SCHEMBL7303920 | 0.82 | KCNK9 (0.73) | KCNK3KCNK9RAB9ANPC1KMT2A |
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-2024050825-A1 | COMPOUNDS AS MLKL INHIBITORS | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2024-03-14 | — | — | WO | disclosed |