Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HBB | P68871 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 10/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 10/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 10/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 10/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 8/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL11853423 | 0.87 | PDE4A (0.51) | KMT2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9350631 | 0.81 | PDE4A (0.51) | KMT2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9293404 | 0.80 | KMT2A (0.74) | SMN1; SMN2KMT2AADORA2B | |
| SCHEMBL2794360 | 0.74 | ADORA2B (0.60) | SMN1; SMN2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL10973640 | 0.73 | TP53 (0.52) | TP53HBBSMN1; SMN2KMT2APDE4A | |
| SCHEMBL22521916 | 0.72 | KMT2A (0.56) | SMN1; SMN2KMT2AADORA2B | |
| SCHEMBL9350638 | 0.72 | PDE4A (0.63) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL10813293 | 0.72 | PDE4A (0.61) | KMT2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL10815371 | 0.71 | ADORA2A (0.51) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL9294204 | 0.71 | ADORA2A (0.50) | PDE4APDE4BPDE4CPDE4DADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0033503-A2 | Medicaments with cytostatic activity and use of cyclic compounds, in which the heterocyclic N-ring atoms are substituted by several glycidyl groups, in pharmaceutical compositions | Henkel Kommanditgesellschaft auf Aktien (DE) | 1981-08-12 | — | — | EP | disclosed |