Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.51 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | PI4KA | P42356 | 2/20 | 0.46 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.46 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.46 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.46 |
| ▸ | DPP4 | P27487 | 1/20 | 0.45 |
| ▸ | SLC28A1 | O00337 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL219553 | 0.87 | ADORA3 (0.49) | ADORA3ADORA2AMAPK1ADORA2BADORA1 | |
| SCHEMBL2463541 | 0.86 | ADORA3 (0.50) | ADORA3HSP90B1ADORA2AMAPK1ADORA2B | |
| SCHEMBL29655156 | 0.86 | ADORA3 (0.50) | ADORA3ADORA2AMAPK1ADORA2BADORA1 | |
| SCHEMBL15798672 | 0.85 | ADORA3 (0.45) | ADORA3ADORA2AMAPK1ADORA2BADORA1 | |
| SCHEMBL28824008 | 0.85 | ADORA2A (0.43) | ADORA3ADORA2AMAPK1ADORA2BADORA1 | |
| SCHEMBL6536153 | 0.85 | PI4KA (0.46) | ADORA3HSP90B1ADORA2AMAPK1ADORA2B | |
| SCHEMBL11576067 | 0.84 | HSP90B1 (0.48) | ADORA3HSP90B1ADORA2AMAPK1ADORA2B | |
| SCHEMBL2761283 | 0.84 | PI4KA (0.47) | ADORA3ADORA2AMAPK1ADORA2BADORA1 | |
| SCHEMBL18011010 | 0.84 | SETD2 (0.44) | ADORA3ADORA2AMAPK1ADORA2BADORA1 | |
| SCHEMBL18011012 | 0.84 | SETD2 (0.44) | ADORA3ADORA2AMAPK1ADORA2BADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6545002-B1 | Treating asthma, diarrhea, insulin resistance, diabetes, ischemia/reprefusion injuries, diabetic retinopathy or hyperbaric oxygen-induced retinopathy | UNIVERSITY OF VIRGINIA PATENT FOUNDATION | 2003-04-08 | — | — | US | disclosed |
| US-6376521-B1 | ANTIINFLAMMATORY AGENTS; ANTIISCHEMIC AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2002-04-23 | — | — | US | disclosed |