Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ4 | P56696 | 4/20 | 0.42 |
| ▸ | KCNQ5 | Q9NR82 | 4/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.42 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.42 |
| ▸ | AAK1 | Q2M2I8 | 8/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21031798 | 0.87 | AAK1 (0.47) | KCNQ4KCNQ5KCNQ2KCNQ3AAK1 | |
| SCHEMBL5869497 | 0.84 | CNR2 (0.44) | KCNQ4KCNQ5KCNQ2KCNQ3AAK1 | |
| SCHEMBL27915724 | 0.82 | AAK1 (0.46) | KCNQ4KCNQ5KCNQ2KCNQ3AAK1 | |
| SCHEMBL5868917 | 0.78 | AAK1 (0.51) | KCNQ4KCNQ5KCNQ2KCNQ3AAK1 | |
| SCHEMBL28626965 | 0.77 | AAK1 (0.46) | KCNQ4KCNQ5KCNQ2KCNQ3AAK1 | |
| SCHEMBL17369611 | 0.77 | KCNQ4 (0.48) | KCNQ4KCNQ5AAK1HDAC1CYP17A1 | |
| SCHEMBL15160030 | 0.76 | GAA (0.52) | KCNQ4KCNQ5AAK1CYP17A1ALOX15 | |
| SCHEMBL3410364 | 0.76 | HPGD (0.49) | AAK1CYP17A1ALOX15 | |
| SCHEMBL753526 | 0.75 | PTGER4 (0.57) | KCNQ4KCNQ5KCNQ2KCNQ3AAK1 | |
| SCHEMBL10083477 | 0.74 | AAK1 (0.47) | KCNQ4KCNQ5AAK1CYP17A1ALOX15 |
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-107043355-A | A kind of hydrochloric acid Emedastine midbody compound and preparation method thereof | 苏州正永生物医药有限公司 | 2017-08-15 | — | — | CN | disclosed |