Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 5/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 3/20 | 0.47 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PTGES | O14684 | 2/20 | 0.47 |
| ▸ | APP | P05067 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28609817 | 0.93 | GSK3B (0.60) | GSK3BLMNANPC1MAPTRAB9A | |
| SCHEMBL8664417 | 0.82 | FDPS (0.58) | GSK3BLMNANPC1MAPTRAB9A | |
| SCHEMBL8664419 | 0.82 | FDPS (0.58) | GSK3BLMNANPC1MAPTRAB9A | |
| SCHEMBL28608967 | 0.82 | F3 (0.56) | LMNANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL30034522 | 0.80 | P4HTM (0.58) | LMNANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL1124609 | 0.80 | P4HTM (0.58) | LMNANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL439860 | 0.80 | CA12 (0.57) | GSK3BMAPTSMN1; SMN2GAAKMT2A | |
| SCHEMBL7397047 | 0.80 | CA12 (0.57) | GSK3BMAPTSMN1; SMN2GAAKMT2A | |
| SCHEMBL20139654 | 0.80 | P4HTM (0.58) | LMNANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL1124610 | 0.80 | P4HTM (0.58) | LMNANPC1MAPTRAB9ASMN1; SMN2 |
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-112707804-A | Novel diketone compounds | 南昌弘益科技有限公司 | 2021-04-27 | — | — | CN | disclosed |