Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.40 |
| ▸ | PTK6 | Q13882 | 2/20 | 0.40 |
| ▸ | CLK1 | P49759 | 2/20 | 0.39 |
| ▸ | CLK2 | P49760 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16693163 | 0.86 | KDM4E (0.47) | ALDH1A1HSD17B10KDM4EL3MBTL1DYRK1A | |
| Cyanide SCHEMBL22130167 | 0.79 | DYRK1A (0.38) | ALDH1A1HSD17B10DYRK1ACLK4PTK6 | |
| SCHEMBL1419323 | 0.77 | CYP2A6 (0.47) | ALDH1A1HSD17B10KDM4EL3MBTL1DYRK1A | |
| SCHEMBL7218395 | 0.77 | ALDH1A1 (0.45) | ALDH1A1HSD17B10KDM4EL3MBTL1DYRK1A | |
| SCHEMBL27362369 | 0.77 | ALDH1A1 (0.45) | ALDH1A1HSD17B10KDM4EL3MBTL1DYRK1A | |
| SCHEMBL18911978 | 0.77 | ALDH1A1 (0.45) | ALDH1A1HSD17B10KDM4EL3MBTL1DYRK1A | |
| SCHEMBL25326544 | 0.73 | DYRK1A (0.36) | ALDH1A1HSD17B10DYRK1ACLK4PTK6 | |
| SCHEMBL25326548 | 0.73 | DYRK1A (0.36) | ALDH1A1HSD17B10DYRK1ACLK4PTK6 | |
| SCHEMBL25913593 | 0.73 | DYRK1A (0.36) | ALDH1A1HSD17B10DYRK1ACLK4PTK6 | |
| SCHEMBL25326717 | 0.73 | DYRK1A (0.36) | ALDH1A1HSD17B10DYRK1ACLK4PTK6 |
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-118420523-A | Pyridine derivative and application thereof in medicine | 成都百裕制药股份有限公司 | 2024-08-02 | — | — | CN | disclosed |
| WO-2015066371-A1 | SPIRO-OXADIAZOLINE COMPOUNDS AS AGONISTS OF α-7-NICOTINIC ACETYLCHOLINE RECEPTORS | FORUM PHARMACEUTICALS, INC. (US) | 2015-05-07 | — | — | WO | disclosed |