Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 9/20 | 0.66 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.66 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.63 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | THPO | P40225 | 1/20 | 0.58 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL10420682 | 0.80 | ADORA2A (0.91) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL10420656 | 0.79 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL10421859 | 0.78 | ADORA2B (0.80) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL7235224 | 0.78 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1 | |
| SCHEMBL21132091 | 0.77 | ADORA2B (0.58) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL10723862 | 0.76 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL9164820 | 0.76 | ADORA2B (0.80) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL1321894 | 0.75 | ADORA2B (1.00) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| Hydrochloric Acid SCHEMBL10420258 | 0.74 | ADORA2A (0.70) | ADORA2BADORA2AADORA3ADORA1KDM4E | |
| SCHEMBL10806138 | 0.73 | ADORA2B (0.81) | ADORA2BADORA2AADORA3ADORA1KDM4E |
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-4968672-A | DRUG DELIVERY; DIURETICS, KIDNEY DISORDERS, HYPOTENSIVE AGENTS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1990-11-06 | — | — | US | disclosed |