Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | MAPT | P10636 | 1/20 | 0.66 |
| ▸ | PARP10 | Q53GL7 | 13/20 | 0.50 |
| ▸ | PARP11 | Q9NR21 | 9/20 | 0.50 |
| ▸ | PARP1 | P09874 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TYMS | P04818 | 1/20 | 0.43 |
| ▸ | F7 | P08709 | 1/20 | 0.43 |
| ▸ | F3 | P13726 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27087781 | 0.82 | KDM4E (0.45) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL17064696 | 0.82 | PARP10 (0.50) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL18875036 | 0.82 | PARP10 (0.50) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL31510260 | 0.82 | KDM4E (0.45) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL27087811 | 0.82 | PARP10 (0.50) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL394896 | 0.80 | MAPT (1.00) | ALDH1A1MAPTTYMS | |
| SCHEMBL26670926 | 0.78 | PARP10 (0.43) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL25947347 | 0.78 | KDM4E (0.46) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL2205282 | 0.78 | MEN1 (0.48) | ALDH1A1MAPTPARP10PARP11PARP1 | |
| SCHEMBL1090688 | 0.78 | ALDH1A1 (0.51) | ALDH1A1MAPTTYMS |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109456308-B | Heterocyclic compounds as ASK inhibitors and their use | 南京圣和药业股份有限公司 | 2022-11-29 | — | — | CN | disclosed |
| CN-109456308-A | Heterocyclic compound and its application as ASK inhibitor | 南京圣和药业股份有限公司 | 2019-03-12 | — | — | CN | disclosed |