Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 6/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.36 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | WNT1 | P04628 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29192580 | 1.00 | HDAC6 (0.37) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| Hydrochloric Acid SCHEMBL29192495 | 0.80 | ADRA2A (0.41) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| Hydrochloric Acid SCHEMBL29192498 | 0.80 | ADRA2A (0.41) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL30358872 | 0.77 | CTSS (0.42) | SLC22A12TRPV1GAACYP11B2 | |
| SCHEMBL29192555 | 0.77 | HDAC6 (0.39) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL30797446 | 0.76 | ADRA2A (0.46) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL29192431 | 0.70 | ADRA2A (0.46) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL29192576 | 0.70 | ADRA2A (0.43) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL27034898 | 0.69 | KDM4E (0.62) | HDAC6ADRA2AADRA2BADRA2CADRA1A | |
| Hydrochloric Acid SCHEMBL29192572 | 0.69 | ADRA2A (0.42) | HDAC6ADRA2AADRA2BADRA2CADRA1A |
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-117651699-A | Compounds and compositions for the treatment of coronavirus related diseases | 诺华股份有限公司 | 2024-03-05 | — | — | CN | disclosed |