Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.43 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PGK1 | P00558 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20241485 | 1.00 | ERN1 (0.43) | ERN1PRKDCALDH1A1TSHRKDM4E | |
| SCHEMBL24773215 | 0.84 | ERN1 (0.42) | ERN1PRKDCALDH1A1TSHRKDM4E | |
| SCHEMBL29993550 | 0.84 | ERN1 (0.42) | ERN1PRKDCALDH1A1TSHRKDM4E | |
| SCHEMBL31749194 | 0.82 | KDM4E (0.31) | KDM4ENFE2L2MAPT | |
| SCHEMBL20241486 | 0.77 | KDM4E (0.43) | ALDH1A1TSHRKDM4ENFE2L2LMNA | |
| SCHEMBL30149898 | 0.77 | KDM4E (0.43) | ALDH1A1TSHRKDM4ENFE2L2LMNA | |
| SCHEMBL20241484 | 0.77 | KDM4E (0.43) | ALDH1A1TSHRKDM4ENFE2L2LMNA | |
| SCHEMBL21767539 | 0.77 | GAA (0.46) | ALDH1A1KDM4ENFE2L2GAA | |
| SCHEMBL21767538 | 0.77 | GAA (0.46) | ALDH1A1KDM4ENFE2L2GAA | |
| SCHEMBL27176097 | 0.76 | SMN1; SMN2 (0.51) | ERN1ALDH1A1TSHRKDM4ETDP1 |
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-111153899-B | Substituted pyridine compound, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2023-12-01 | — | — | CN | disclosed |