Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 9/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.45 |
| ▸ | PI4KA | P42356 | 3/20 | 0.45 |
| ▸ | PI4K2B | Q8TCG2 | 3/20 | 0.45 |
| ▸ | PI4K2A | Q9BTU6 | 3/20 | 0.45 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | TEK | Q02763 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL17574453 | 0.82 | TLR8 (0.47) | ADORA2AADORA1ADORA2B | |
| SCHEMBL27684254 | 0.81 | TLR7 (0.50) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL27684253 | 0.79 | PI4KA (0.38) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL2747761 | 0.79 | FGFR1 (0.41) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL27684210 | 0.78 | ADORA2A (0.36) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL27664613 | 0.77 | HSP90B1 (0.37) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL27684236 | 0.76 | IRAK4 (0.42) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL22730044 | 0.75 | CDK1 (0.44) | CDK1CCNB1CCNE1CDK2 | |
| Hydrochloric Acid SCHEMBL27684235 | 0.74 | IRAK4 (0.41) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL27664611 | 0.72 | ALDH1A1 (0.36) | ADORA2ACDK1EGFR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1993362-B | Fused Heterocyclic Compounds | TAKEDA PHARMACEUTICAL | 2010-12-15 | — | — | CN | disclosed |
| CN-101611041-A | Condensed heterocyclic compouds | TAKEDA PHARMACEUTICAL (JP) | 2009-12-23 | — | — | CN | disclosed |
| CN-1993362-A | Fused Heterocyclic Compounds | TAKEDA PHARMACEUTICAL (JP) | 2007-07-04 | — | — | CN | disclosed |