Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 12/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.40 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23778205 | 0.85 | ATM (0.46) | GRM5 | |
| SCHEMBL23779080 | 0.82 | HDAC6 (0.49) | GRM5HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL24186759 | 0.80 | MAPT (0.47) | HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL24186754 | 0.74 | PDCD1 (0.44) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL14913284 | 0.70 | GRM5 (0.46) | GRM5HDAC6 | |
| SCHEMBL26765948 | 0.68 | GRM5 (0.46) | GRM5HDAC6 | |
| SCHEMBL25412001 | 0.68 | GRM5 (0.46) | GRM5HDAC6 | |
| SCHEMBL29142222 | 0.68 | GRM5 (0.46) | GRM5HDAC6 | |
| SCHEMBL12334175 | 0.68 | NPC1 (0.47) | GRM5 | |
| SCHEMBL28785444 | 0.66 | GRM5 (0.79) | GRM5 |
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-112969704-A | Urea 6, 7-dihydro-4H-pyrazolo [1,5-a ] pyrazine active agents against hepatitis b virus HBV | 艾库里斯有限及两合公司 | 2021-06-15 | — | — | CN | disclosed |