Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 10/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GMNN | O75496 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7020242 | 0.92 | ADORA1 (0.61) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL7026477 | 0.86 | ADORA1 (0.52) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL8001985 | 0.83 | ADORA1 (0.45) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL1388395 | 0.80 | ADORA1 (0.43) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL563337 | 0.79 | ADORA1 (0.62) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL7378595 | 0.79 | ADORA1 (0.69) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL7425220 | 0.79 | ADORA1 (0.69) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL8002306 | 0.78 | MAPT (0.39) | ADORA1ADORA2AADORA3TSHR | |
| SCHEMBL7874298 | 0.77 | ADORA1 (0.47) | ADORA1ADORA2AADORA2BMEN1GMNN | |
| SCHEMBL1387996 | 0.76 | ADORA1 (0.43) | ADORA1ADORA2AADORA2BMEN1GMNN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6294541-B1 | ENZYME INHIBITORS USING PURINE COMPOUNDS AS ANTIHISTAMINES | EURO-CELTIQUE S.A. (LU) | 2001-09-25 | — | — | US | claimed |
| EP-0916673-A1 | 6-Amino purine derivatives having PDE-IV inhibition activity | Euroceltique S.A. (LU) | 1999-05-19 | — | — | EP | disclosed |
| EP-0916672-A1 | 6-Amino purine derivatives having PDE-IV inhibition activity and intermediates | Euroceltique S.A. (LU) | 1999-05-19 | — | — | EP | disclosed |