Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.53 |
| ▸ | GRM5 | P41594 | 8/20 | 0.49 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | F12 | P00748 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7428533 | 0.86 | ADORA2A (0.60) | ADORA2AL3MBTL1NPC1ALDH1A1HTT | |
| SCHEMBL7708776 | 0.86 | ADORA2A (0.53) | ADORA2AGRM5DCTPP1L3MBTL1NPC1 | |
| SCHEMBL7711376 | 0.86 | ADORA2A (0.53) | ADORA2AGRM5DCTPP1L3MBTL1NPC1 | |
| SCHEMBL7427435 | 0.84 | ADORA2A (0.54) | ADORA2AGRM5DCTPP1L3MBTL1NPC1 | |
| SCHEMBL7709217 | 0.83 | GRM5 (0.50) | ADORA2AGRM5DCTPP1NPC1ALDH1A1 | |
| SCHEMBL7708837 | 0.82 | GRM5 (0.52) | ADORA2AGRM5DCTPP1L3MBTL1NPC1 | |
| SCHEMBL7705845 | 0.82 | ADORA2A (0.49) | ADORA2AGRM5L3MBTL1NPC1HTT | |
| SCHEMBL7431418 | 0.81 | ADORA2A (0.56) | ADORA2AGRM5L3MBTL1NPC1ALDH1A1 | |
| SCHEMBL7487093 | 0.81 | ADORA2A (0.45) | ADORA2AGRM5L3MBTL1NPC1ALDH1A1 | |
| SCHEMBL7708387 | 0.80 | BACE1 (0.40) | ADORA2AL3MBTL1NPC1ALDH1A1HTT |
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-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |