Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 12/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30353593 | 1.00 | ADORA1 (0.36) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL28342788 | 0.91 | ADORA1 (0.38) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL30353575 | 0.91 | ADORA1 (0.38) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL30209556 | 0.85 | MAP4K4 (0.39) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL28345986 | 0.85 | MAP4K4 (0.39) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL21621165 | 0.84 | ADORA2A (0.50) | ADORA1RPS6KA3ADORA2AADORA2B | |
| SCHEMBL30353567 | 0.80 | ADORA1 (0.36) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL28342670 | 0.80 | ADORA1 (0.36) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL30353569 | 0.80 | ADORA1 (0.53) | ADORA1RPS6KA3KMT2AADORA2AADORA2B | |
| SCHEMBL30353590 | 0.80 | ADORA1 (0.45) | ADORA1RPS6KA3KMT2AADORA2AHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110655509-B | 2-aminopyrimidine derivatives, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2023-01-24 | — | — | CN | disclosed |
| CN-110655509-A | 2-aminopyrimidine derivatives, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2020-01-07 | — | — | CN | disclosed |