Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.76 |
| ▸ | AKR1C3 | P42330 | 9/20 | 0.70 |
| ▸ | MEP1B | Q16820 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | F2 | P00734 | 1/20 | 0.54 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.54 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.54 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL13614830 | 1.00 | CYP2C19 (0.76) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| SCHEMBL13614936 | 0.88 | CYP2C19 (0.70) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| SCHEMBL27101333 | 0.87 | CYP2C19 (0.57) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| SCHEMBL1017949 | 0.86 | CYP2C19 (1.00) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| Hydrochloric Acid SCHEMBL5125599 | 0.85 | CYP2C19 (0.72) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| SCHEMBL22557351 | 0.85 | CYP2C19 (0.56) | CYP2C19AKR1C3MEP1BKMT2AHTT | |
| SCHEMBL13381555 | 0.85 | CYP2C19 (0.76) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| SCHEMBL2281070 | 0.84 | CYP2C19 (0.70) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| SCHEMBL26212220 | 0.84 | CYP2C19 (0.70) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 | |
| SCHEMBL26731607 | 0.84 | CYP2C19 (0.70) | CYP2C19AKR1C3MEP1BKMT2AMAPK1 |
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-112424201-B | Protein kinase inhibitors that promote liver regeneration or reduce or prevent hepatocyte death | 海帕瑞吉尼克斯股份有限公司 | 2024-04-02 | — | — | CN | disclosed |