Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.45 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.45 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.45 |
| ▸ | KCNMA1 | Q12791 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28057003 | 0.84 | KDM4E (0.41) | SIRT2SIRT1SIRT3HDAC3HDAC4 | |
| SCHEMBL13814010 | 0.84 | SIRT2 (0.47) | SIRT2SIRT1SIRT3KCNMA1HDAC3 | |
| SCHEMBL27601679 | 0.81 | HDAC3 (0.38) | SIRT2SIRT1SIRT3HDAC3HDAC4 | |
| SCHEMBL11539502 | 0.81 | HDAC3 (0.57) | SIRT2SIRT1SIRT3HDAC3HDAC4 | |
| SCHEMBL25454219 | 0.80 | SIRT2 (0.45) | SIRT2SIRT1SIRT3KCNMA1HDAC3 | |
| SCHEMBL27800469 | 0.79 | HDAC3 (0.36) | SIRT2SIRT1SIRT3HDAC3HDAC4 | |
| SCHEMBL13879706 | 0.78 | HDAC3 (0.57) | SIRT2SIRT1SIRT3KCNMA1HDAC3 | |
| SCHEMBL12204548 | 0.76 | KCNMA1 (0.43) | SIRT2SIRT1SIRT3KCNMA1ALDH1A1 | |
| SCHEMBL28826665 | 0.76 | HDAC3 (0.45) | SIRT2SIRT1SIRT3HDAC3HDAC4 | |
| SCHEMBL13604188 | 0.75 | KCNMA1 (0.42) | SIRT2SIRT1SIRT3KCNMA1HDAC3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101691370-A | Triazolo[4,5-d] pyrimidine derivatives and their use as purinergic receptor antagonists | VERNALIS RES LTD | 2010-04-07 | — | — | CN | disclosed |
| CN-101214248-A | Triazolo[4,5-d] pyrimidine derivatives and their application as purinergic receptor antagonists | VERNALIS RES LTD (GB) | 2008-07-09 | — | — | CN | disclosed |
| CN-1496262-A | Triazolo [4, 5-d ] pyrimidine derivatives and their use as purinergic receptor antagonists | О | 2004-05-12 | — | — | CN | disclosed |