Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL7705975 | 0.86 | GBA1 (0.48) | DHFRGBA1KDM4E | |
| SCHEMBL7480538 | 0.77 | ADORA2A (0.65) | ADORA2AADORA1 | |
| SCHEMBL7430368 | 0.76 | ADORA2A (0.66) | ADORA2AADORA1 | |
| SCHEMBL7482833 | 0.74 | ADORA2A (0.56) | ADORA2AADORA1 | |
| SCHEMBL6632327 | 0.73 | ADRA2A (0.59) | ADORA2ADHFR | |
| SCHEMBL6867881 | 0.70 | ADORA2A (0.63) | ADORA2A | |
| SCHEMBL7427470 | 0.66 | ADORA2A (0.59) | ADORA2AADORA1 | |
| SCHEMBL21588453 | 0.66 | KDM4E (0.51) | DHFRKDM4E | |
| SCHEMBL21588421 | 0.66 | DHFR (0.53) | DHFRGBA1KDM4E | |
| SCHEMBL7711605 | 0.66 | ADORA2A (0.55) | ADORA2A |
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 |