Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | VCP | P55072 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL9019861 | 0.87 | ALDH1A1 (0.34) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL9019744 | 0.86 | ALDH1A1 (0.32) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL8777006 | 0.86 | KDM4E (0.35) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL9019839 | 0.84 | CDK1 (0.31) | — | |
| SCHEMBL8205815 | 0.82 | ALDH1A1 (0.38) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL8210030 | 0.82 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL965011 | 0.82 | ALDH1A1 (0.46) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL8777020 | 0.81 | ALDH1A1 (0.36) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL8777015 | 0.81 | PDE3A (0.40) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL9845278 | 0.81 | SYK (0.31) | MEN1CYP3A4KMT2A |
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 |