Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KB1 | P23443 | 14/20 | 0.45 |
| ▸ | AURKA | O14965 | 3/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
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 SCHEMBL23360118 | 0.99 | RPS6KB1 (0.45) | RPS6KB1AURKACHEK1KCNH2MMP2 | |
| Hydrochloric Acid SCHEMBL23360115 | 0.99 | RPS6KB1 (0.45) | RPS6KB1AURKACHEK1KCNH2MMP2 | |
| Hydrochloric Acid SCHEMBL23360633 | 0.93 | RPS6KB1 (0.42) | RPS6KB1AURKAMMP2USP2CYP1A2 | |
| Hydrochloric Acid SCHEMBL23359896 | 0.88 | RPS6KB1 (0.48) | RPS6KB1AURKACHEK1KCNH2USP2 | |
| Hydrochloric Acid SCHEMBL23359893 | 0.88 | RPS6KB1 (0.48) | RPS6KB1AURKACHEK1KCNH2USP2 | |
| SCHEMBL29862796 | 0.86 | RPS6KB1 (0.44) | RPS6KB1AURKACHEK1KCNH2 | |
| Hydrochloric Acid SCHEMBL23360320 | 0.85 | RPS6KB1 (0.43) | RPS6KB1AURKACHEK1KCNH2 | |
| Hydrochloric Acid SCHEMBL23360323 | 0.85 | RPS6KB1 (0.43) | RPS6KB1AURKACHEK1KCNH2 | |
| SCHEMBL23359826 | 0.82 | RPS6KB1 (0.41) | RPS6KB1MMP2USP2CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL23360587 | 0.82 | RPS6KB1 (0.45) | RPS6KB1AURKAUSP2CYP1A2CYP2C9 |
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 |