Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 15/20 | 0.74 |
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.74 |
| ▸ | ADORA1 | P30542 | 10/20 | 0.70 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7229037 | 1.00 | ADORA2B (0.74) | ADORA2BADORA3ADORA1ADORA2ACYP3A4 | |
| SCHEMBL7220060 | 0.85 | ADORA2B (1.00) | ADORA2BADORA3ADORA1ADORA2ACYP3A4 | |
| SCHEMBL7220057 | 0.85 | ADORA2B (1.00) | ADORA2BADORA3ADORA1ADORA2ACYP3A4 | |
| SCHEMBL7228404 | 0.83 | ADORA2B (0.79) | ADORA2BADORA3ADORA1ADORA2ACYP3A4 | |
| SCHEMBL7228400 | 0.83 | ADORA2B (0.79) | ADORA2BADORA3ADORA1ADORA2ACYP3A4 | |
| SCHEMBL28457457 | 0.80 | ADORA2B (0.69) | ADORA2BADORA3ADORA1ADORA2A | |
| SCHEMBL6554039 | 0.72 | ADORA2B (0.62) | ADORA2BADORA3ADORA1ADORA2A | |
| SCHEMBL6554035 | 0.72 | ADORA2B (0.62) | ADORA2BADORA3ADORA1ADORA2A | |
| SCHEMBL7783053 | 0.71 | ADORA2B (0.57) | ADORA2BADORA3ADORA1ADORA2AALDH1A1 | |
| Ethylene SCHEMBL6745653 | 0.70 | ADORA2B (0.74) | ADORA2BADORA3ADORA1ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |