Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 8/20 | 0.64 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | LGMN | Q99538 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL6554077 | 0.91 | ADORA2B (0.72) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL6554070 | 0.91 | ADORA2B (0.72) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9153363 | 0.89 | ADORA2B (0.63) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9153373 | 0.89 | ADORA2B (0.63) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9157110 | 0.86 | ADORA2B (0.65) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9155023 | 0.86 | ADORA2B (0.65) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9157123 | 0.86 | ADORA2B (0.65) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9155034 | 0.86 | ADORA2B (0.65) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9637190 | 0.85 | ADORA2B (0.63) | ADORA2BADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL9637193 | 0.85 | ADORA2B (0.63) | ADORA2BADORA3ADORA2AADORA1KDM4E |
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-0203721-A2 | 8-Phenyl xanthines | THE WELLCOME FOUNDATION LIMITED (GB) | 1986-12-03 | — | — | EP | disclosed |