Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL9751587 | 0.71 | PKM (0.45) | PKMMAPTRAB9ANPC1CHRM2 | |
| SCHEMBL2354792 | 0.70 | PKM (0.59) | PKMMAPTRAB9ANPC1CHRM2 | |
| SCHEMBL6482190 | 0.69 | PKM (0.58) | PKMMAPTRAB9ANPC1CHRM2 | |
| Hydrochloric Acid SCHEMBL5357792 | 0.69 | PKM (0.58) | PKMMAPTRAB9ANPC1CHRM2 | |
| SCHEMBL277681 | 0.66 | PKM (0.54) | PKMMAPTRAB9ANPC1GAA | |
| SCHEMBL3880837 | 0.66 | MAPT (0.41) | PKMMAPTCHRM2CHRM4CHRM5 | |
| SCHEMBL13957759 | 0.66 | MAPT (0.41) | PKMMAPTCHRM2CHRM4CHRM5 | |
| Hydrochloric Acid SCHEMBL10460823 | 0.65 | PKM (0.53) | PKMMAPTRAB9ANPC1GAA | |
| SCHEMBL17740783 | 0.64 | MAPT (0.60) | PKMMAPTRAB9ANPC1GAA | |
| SCHEMBL13658035 | 0.64 | PKM (0.69) | PKMMAPTRAB9ANPC1GAA |
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-2021107680-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-06-03 | — | — | WO | disclosed |