Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR4 | P31391 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.40 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.40 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.40 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6334775 | 0.93 | ALDH1A1 (0.43) | HDAC4HDAC3HDAC1HDAC2HDAC6 | |
| Hydrochloric Acid SCHEMBL6329702 | 0.92 | ALDH1A1 (0.42) | HDAC4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL5327730 | 0.83 | GRIN2D (0.46) | SSTR4GRIN2DGRIN3BGRIA1GRIA2 | |
| SCHEMBL28324849 | 0.82 | KDM1A (0.44) | HDAC4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL1287520 | 0.81 | OPRL1 (0.41) | HDAC4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL23023788 | 0.79 | OPRM1 (0.47) | ALDH1A1 | |
| SCHEMBL31222650 | 0.75 | SMN1; SMN2 (0.40) | HDAC4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL11692509 | 0.75 | POLB (0.60) | SSTR4HDAC4HDAC3HDAC1HDAC2 | |
| SCHEMBL6620132 | 0.74 | SSTR4 (0.59) | SSTR4HDAC4HDAC3HDAC1HDAC2 | |
| SCHEMBL28320702 | 0.74 | SSTR4 (0.43) | SSTR4HDAC4HDAC3HDAC1HDAC2 |
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-110172058-A | 7- azaspiro [5.6] dodecane -10- ketone compounds and preparation method thereof and purposes | 中国医科大学 | 2019-08-27 | — | — | CN | disclosed |