Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 12/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | BCR | P11274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 10/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.37 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | UBE2N | P61088 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12592691 | 0.93 | ADORA2A (0.41) | ADORA2AABL1BCRADORA1CCNT1 | |
| Hydrochloric Acid SCHEMBL1760985 | 0.92 | ADORA2A (0.40) | ADORA2AABL1BCRADORA1CCNT1 | |
| SCHEMBL4054563 | 0.84 | ADORA2A (0.40) | ADORA2AADORA1ADORA2BADORA3 | |
| SCHEMBL13176908 | 0.83 | ADORA2A (0.48) | PKMADORA2AADORA1ADORA2BADORA3 | |
| Trifluoroacetic Acid SCHEMBL1761052 | 0.82 | ACHE (0.46) | POLB | |
| Trifluoroacetic Acid SCHEMBL1760939 | 0.81 | ADORA2A (0.39) | ADORA2AADORA1ADORA2BADORA3 | |
| SCHEMBL1761075 | 0.81 | ADORA2A (0.40) | ADORA2AADORA1ADORA2BADORA3 | |
| SCHEMBL1760961 | 0.79 | MAPT (0.41) | ADORA2AADORA1ADORA2BADORA3 | |
| SCHEMBL1760991 | 0.79 | ADORA2A (0.46) | ADORA2AADORA1ADORA2BADORA3 | |
| Trifluoroacetic Acid SCHEMBL1760931 | 0.79 | — | — |
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-7947692-B2 | Substituted thiazolo[5,4-d]pyrimidine urea derivatives | HOFFMANN-LA ROCHE INC. (US) | 2011-05-24 | — | — | US | disclosed |