Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.37 |
| ▸ | JAK2 | O60674 | 3/20 | 0.37 |
| ▸ | JAK1 | P23458 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29056279 | 0.89 | PDE4B (0.40) | PDE4BPAX8PDE4DJAK2JAK1 | |
| SCHEMBL29056207 | 0.83 | PDE4B (0.50) | PDE4BPAX8PDE4DJAK2JAK1 | |
| SCHEMBL29056201 | 0.80 | PDE4B (0.47) | PDE4BPDE4DSLC22A12MAPTKDM4E | |
| SCHEMBL29056290 | 0.79 | ABCG2 (0.53) | MAPTKDM4ETP53 | |
| SCHEMBL29056286 | 0.78 | SLC22A12 (0.55) | PDE4BPDE4DSLC22A12MAPTKDM4E | |
| SCHEMBL29056228 | 0.78 | SLC22A12 (0.55) | PDE4BPDE4DSLC22A12MAPTKDM4E | |
| SCHEMBL29056230 | 0.78 | PDE4B (0.41) | PDE4BPDE4DSLC22A12MAPTKDM4E | |
| SCHEMBL30542645 | 0.78 | PTGES (0.45) | PDE4BPDE4DSLC22A12MAPTKDM4E | |
| SCHEMBL29056289 | 0.78 | SLC22A12 (0.41) | PDE4BPDE4DSLC22A12MAPTKDM4E | |
| SCHEMBL29056213 | 0.78 | L3MBTL1 (0.48) | PDE4BMAPTKDM4ECYP2C9TP53 |
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-116640095-A | Diaryl amine derivative containing aliphatic carboxyl and preparation method and application thereof | 山东大学 | 2023-08-25 | — | — | CN | disclosed |