Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.58 |
| ▸ | P2RY12 | Q9H244 | 12/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | PDE1A | P54750 | 1/20 | 0.37 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.37 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14709077 | 0.84 | KDM1A (0.44) | KDM1AP2RY12 | |
| SCHEMBL5729393 | 0.83 | P2RY12 (0.46) | KDM1AP2RY12ADORA2A | |
| SCHEMBL5729389 | 0.83 | P2RY12 (0.46) | KDM1AP2RY12ADORA2A | |
| SCHEMBL5729958 | 0.83 | P2RY12 (0.46) | KDM1AP2RY12ADORA2A | |
| SCHEMBL6075252 | 0.83 | P2RY12 (0.46) | KDM1AP2RY12ADORA2A | |
| SCHEMBL21138862 | 0.83 | KDM1A (0.40) | KDM1APDE5APDE1APDE1BPDE1C | |
| SCHEMBL5728919 | 0.79 | P2RY12 (0.42) | KDM1AP2RY12 | |
| SCHEMBL5728911 | 0.79 | P2RY12 (0.42) | KDM1AP2RY12 | |
| SCHEMBL21268651 | 0.78 | KDM1A (0.44) | KDM1APDE5APDE1APDE1BPDE1C | |
| SCHEMBL29385954 | 0.78 | KDM1A (0.44) | KDM1APDE5APDE1APDE1BPDE1C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013023511-A1 | TRIAZOLOPYRIMIDINE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2013-02-21 | — | — | WO | disclosed |