Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | VCP | P55072 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | TKT | P29401 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9021299 | 0.88 | ACHE (0.42) | ACHEBCHECYP1A2 | |
| SCHEMBL9019784 | 0.88 | ALDH1A1 (0.36) | ACHEALDH1A1BCHECYP1A2 | |
| SCHEMBL9019743 | 0.88 | ACHE (0.33) | ACHEBCHE | |
| SCHEMBL9019807 | 0.84 | PDE3A (0.32) | PDE3ALMNAMEN1ALDH1A1CYP3A4 | |
| SCHEMBL9019783 | 0.81 | ADORA2A (0.35) | PDE3ALMNAMEN1ALDH1A1CYP3A4 | |
| SCHEMBL9019764 | 0.79 | PDE3A (0.38) | PDE3ALMNAMEN1ALDH1A1CYP3A4 | |
| SCHEMBL9019840 | 0.79 | HPGD (0.46) | PDE3AMEN1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL9021161 | 0.79 | BCHE (0.50) | ACHELMNABCHE | |
| SCHEMBL9021782 | 0.79 | ACHE (0.43) | ACHEBCHECYP1A2 | |
| SCHEMBL9575559 | 0.77 | ALDH1A1 (0.41) | PDE3ALMNAMEN1ALDH1A1CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0452680-B1 | Substituted purines, process for their preparation and their use as antiviral agents | HOECHST AG (DE) | 1996-11-06 | — | — | EP | disclosed |
| EP-0452680-A1 | Substituted purines, process for their preparation and their use as antiviral agents | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-10-23 | — | — | EP | disclosed |