Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.51 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.51 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 4/20 | 0.45 |
| ▸ | ATAD2 | Q6PL18 | 4/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.44 |
| ▸ | KMT5B | Q4FZB7 | 2/20 | 0.44 |
| ▸ | KMT5C | Q86Y97 | 2/20 | 0.44 |
| ▸ | ITK | Q08881 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.40 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.39 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
| ▸ | CCNK | O75909 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL23359669 | 0.99 | HTR1A (0.50) | HTR1AADRA1DADRA1AADRA1BPIK3CA | |
| Hydrochloric Acid SCHEMBL23359667 | 0.99 | HTR1A (0.50) | HTR1AADRA1DADRA1AADRA1BPIK3CA | |
| SCHEMBL3632517 | 0.85 | PIK3CA (0.50) | PIK3CABRD4ATAD2CHEK2KMT5B | |
| SCHEMBL3632518 | 0.85 | PIK3CA (0.50) | PIK3CABRD4ATAD2CHEK2KMT5B | |
| SCHEMBL3631574 | 0.84 | HTR1A (0.52) | HTR1AADRA1DADRA1AADRA1BPIK3CA | |
| SCHEMBL3631572 | 0.84 | HTR1A (0.52) | HTR1AADRA1DADRA1AADRA1BPIK3CA | |
| SCHEMBL29862969 | 0.84 | HTR1A (0.52) | HTR1AADRA1DADRA1AADRA1BPIK3CA | |
| Hydrochloric Acid SCHEMBL23360451 | 0.84 | PIK3CA (0.49) | PIK3CABRD4ATAD2CHEK2KMT5B | |
| Hydrochloric Acid SCHEMBL23360449 | 0.84 | PIK3CA (0.49) | PIK3CABRD4ATAD2CHEK2KMT5B | |
| Hydrochloric Acid SCHEMBL23360242 | 0.84 | KMT5B (0.54) | PIK3CACHEK2KMT5BKMT5C |
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-114867719-A | Pyrrolidine and piperidine compounds | 柳韩洋行 | 2022-08-05 | — | — | CN | disclosed |