Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 13/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6871208 | 0.83 | F2 (0.39) | ADORA2AITK | |
| SCHEMBL6871350 | 0.82 | ADORA2A (0.41) | ADORA2A | |
| SCHEMBL6870319 | 0.81 | ADORA2A (0.49) | ADORA2AHPGD | |
| SCHEMBL6867629 | 0.81 | ADORA2A (0.41) | ADORA2AHPGD | |
| SCHEMBL6863074 | 0.81 | ADORA2A (0.62) | POLBADORA2AALDH1A1HPGDTSHR | |
| SCHEMBL6863359 | 0.80 | ADORA2A (0.47) | ADORA2AHPGDTSHRSMN1; SMN2 | |
| SCHEMBL6863363 | 0.80 | ADORA2A (0.47) | ADORA2AHPGDTSHRSMN1; SMN2 | |
| SCHEMBL6871945 | 0.80 | ADORA2A (0.42) | POLBADORA2AALDH1A1HPGDTSHR | |
| SCHEMBL6863389 | 0.80 | NPC1 (0.47) | POLBADORA2AHPGDNPC1RAB9A | |
| SCHEMBL6863143 | 0.80 | ADORA2A (0.58) | ADORA2AHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |