Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 6/20 | 0.31 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.31 |
| ▸ | ADA | P00813 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.30 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.30 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.30 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.30 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.30 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.30 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29645600 | 0.94 | PDK2 (0.32) | HSP90AA1ADORA3ADORA2AADORA1P2RX7 | |
| SCHEMBL29645421 | 0.89 | TTK (0.31) | TTK | |
| SCHEMBL31149922 | 0.86 | LIMK1 (0.35) | ADORA3ADORA2AADORA1PDE3BPDE3A | |
| SCHEMBL29645561 | 0.86 | MAP3K5 (0.34) | P2RX7SCN9A | |
| SCHEMBL29645537 | 0.86 | MAPT (0.41) | ADORA3ADORA1 | |
| SCHEMBL29645837 | 0.84 | EGFR (0.36) | P2RX7SLC40A1PSEN1PSEN2APH1B | |
| SCHEMBL31150076 | 0.84 | JAK2 (0.33) | ADORA3ADORA2AADORA1 | |
| SCHEMBL29645682 | 0.84 | ADORA3 (0.40) | ADORA3ADORA2AADORA1P2RX7 | |
| SCHEMBL29645914 | 0.83 | NR1H2 (0.40) | ADORA3ADORA2AADORA1P2RX7 | |
| SCHEMBL29645601 | 0.83 | MAPT (0.35) | ADORA3P2RX7 |
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-114466850-A | [1,2,4] triazolo [1,5-C ] quinazolin-5-amines | 拜耳股份有限公司 | 2022-05-10 | — | — | CN | claimed |