Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 9/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | BCR | P11274 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6863122 | 0.80 | ADORA2A (0.45) | ADORA2AADORA1ADORA2BHPGD | |
| SCHEMBL7148133 | 0.77 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BNPC1RAB9A | |
| SCHEMBL6872077 | 0.76 | ADORA2A (0.42) | ADORA2AADORA1ADORA2BKDM4EALDH1A1 | |
| SCHEMBL7427221 | 0.76 | KDM4E (0.40) | ADORA2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL7429024 | 0.75 | ADORA2A (0.39) | ADORA2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6871431 | 0.75 | ADORA2A (0.48) | ADORA2AADORA1ADORA2BALDH1A1KMT2A | |
| SCHEMBL7480280 | 0.75 | ADORA2A (0.59) | ADORA2AADORA1ADORA2BNPC1RAB9A | |
| SCHEMBL6863814 | 0.74 | ADORA2A (0.67) | ADORA2AKDM4EHPGDABL1BCR | |
| SCHEMBL6870494 | 0.74 | ADORA2A (0.53) | ADORA2AADORA1ADORA2BHPGDABL1 | |
| SCHEMBL6870030 | 0.74 | ADORA2A (0.66) | ADORA2AKDM4EHPGDABL1BCR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1214322-A2 | AMINO-TRIAZOLOPYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-06-19 | — | — | EP | disclosed |
| US-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |
| WO-2001017999-A2 | AMINO-TRIAZOLOPYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-03-15 | — | — | WO | disclosed |