Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 9/20 | 0.58 |
| ▸ | PDE4D | Q08499 | 9/20 | 0.58 |
| ▸ | PDE4A | P27815 | 8/20 | 0.58 |
| ▸ | PDE4C | Q08493 | 8/20 | 0.58 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.57 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.57 |
| ▸ | BRD4 | O60885 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17205316 | 0.90 | PDE4B (0.61) | PDE4BPDE4DPDE4APDE4CSMPD1 | |
| SCHEMBL28033750 | 0.88 | SMPD1 (0.73) | SMPD1HDAC1HDAC8HDAC6BRD4 | |
| SCHEMBL28336423 | 0.85 | LMNA (0.55) | PDE4BPDE4DPDE4APDE4CHDAC1 | |
| SCHEMBL17204538 | 0.84 | SMPD1 (0.57) | PDE4BPDE4DPDE4APDE4CSMPD1 | |
| SCHEMBL22288724 | 0.82 | RXRA (0.53) | SMPD1HDAC1HDAC8HDAC6BRD4 | |
| SCHEMBL29204556 | 0.82 | PDE4B (0.49) | PDE4BPDE4DPDE4APDE4CKDM4E | |
| SCHEMBL4277044 | 0.81 | PDE4A (0.60) | PDE4BPDE4DPDE4APDE4CSMPD1 | |
| SCHEMBL29120991 | 0.80 | PDE4B (0.72) | PDE4BPDE4DPDE4APDE4C | |
| SCHEMBL4279475 | 0.79 | PDE4A (0.57) | PDE4BPDE4DPDE4APDE4CSMPD1 | |
| SCHEMBL23067403 | 0.78 | KMT2A (0.57) | PDE4BPDE4DPDE4APDE4CSMPD1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105085429-B | Aromatic heterocyclic derivative and application thereof in medicines | 广东东阳光药业有限公司 | 2019-12-10 | — | — | CN | disclosed |
| CN-105399698-B | Aromatic heterocyclic derivatives and its application in drug | 广东东阳光药业有限公司 | 2018-08-10 | — | — | CN | disclosed |
| CN-105399698-A | Aromatic heterocyclic derivatives and applications of aromatic heterocyclic derivatives in medicines | GUANGDONG HEC PHARMACEUTICAL | 2016-03-16 | — | — | CN | disclosed |
| CN-105085429-A | Heteroaromatic derivative and application thereof to medicament | GUANGDONG HEC PHARMACEUTICAL | 2015-11-25 | — | — | CN | disclosed |