Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 10/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.45 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28345465 | 1.00 | ADORA1 (0.50) | ADORA1ADORA2ALMNAHTTGPR55 | |
| SCHEMBL28342652 | 0.91 | ADORA1 (0.45) | ADORA1ADORA2ALMNAHTTGPR55 | |
| SCHEMBL30353590 | 0.91 | ADORA1 (0.45) | ADORA1ADORA2ALMNAHTTGPR55 | |
| SCHEMBL30353594 | 0.83 | ADORA1 (0.39) | ADORA1ADORA2ARPS6KA3KMT2AMEN1 | |
| SCHEMBL30353566 | 0.83 | ADORA1 (0.44) | ADORA1ADORA2ARPS6KA3KMT2A | |
| SCHEMBL28345412 | 0.83 | ADORA1 (0.44) | ADORA1ADORA2ARPS6KA3KMT2A | |
| SCHEMBL28345346 | 0.83 | ADORA1 (0.39) | ADORA1ADORA2ARPS6KA3KMT2AMEN1 | |
| SCHEMBL30353575 | 0.82 | ADORA1 (0.38) | ADORA1ADORA2ARPS6KA3KMT2AMEN1 | |
| SCHEMBL29947054 | 0.82 | ADORA2A (0.48) | ADORA1ADORA2A | |
| SCHEMBL28938537 | 0.82 | ADORA2A (0.48) | ADORA1ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |