Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.70 |
| ▸ | DHFR | P00374 | 6/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.51 |
| ▸ | HEXA | P06865 | 1/20 | 0.50 |
| ▸ | HEXB | P07686 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | MET | P08581 | 1/20 | 0.47 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.47 |
| ▸ | PRKACA | P17612 | 1/20 | 0.47 |
| ▸ | LTK | P29376 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1388276 | 1.00 | ADORA1 (0.70) | ADORA1DHFRRAB9AFGFR1HEXA | |
| SCHEMBL30401146 | 0.83 | DHFR (0.71) | ADORA1DHFRFGFR1ADORA2AMAP4K4 | |
| SCHEMBL1388358 | 0.83 | DHFR (0.71) | ADORA1DHFRFGFR1ADORA2AMAP4K4 | |
| SCHEMBL27631899 | 0.81 | DHFR (0.69) | ADORA1DHFRADORA2AMAP2K1 | |
| SCHEMBL29913330 | 0.80 | DHFR (1.00) | ADORA1DHFRFGFR1ADORA2AMAP4K4 | |
| SCHEMBL1388331 | 0.80 | DHFR (0.67) | ADORA1DHFRADORA2AMAP4K4CDK9 | |
| SCHEMBL1388562 | 0.80 | DHFR (1.00) | ADORA1DHFRFGFR1ADORA2AMAP4K4 | |
| SCHEMBL1116404 | 0.80 | ADORA1 (0.70) | ADORA1DHFRFGFR1ADORA2AMAP4K4 | |
| SCHEMBL1388335 | 0.80 | DHFR (0.67) | ADORA1DHFRRAB9AFGFR1ADORA2A | |
| SCHEMBL4457331 | 0.80 | ADORA2A (0.72) | ADORA1DHFRFGFR1ADORA2AFYN |
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-113061116-B | Aminopyrimidine compound, preparation method, composition and application thereof | 上海医药工业研究院 | 2023-07-25 | — | — | CN | disclosed |