Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9480301 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNATSHRPOLBKMT2A | |
| SCHEMBL27690275 | 0.87 | ALDH1A1 (0.49) | ALDH1A1LMNATSHRPOLBKMT2A | |
| SCHEMBL28104610 | 0.86 | ALDH1A1 (0.50) | ALDH1A1LMNATSHRPOLBKMT2A | |
| SCHEMBL9193734 | 0.86 | ALDH1A1 (0.51) | ALDH1A1LMNATSHRPOLBKMT2A | |
| SCHEMBL2635391 | 0.85 | MRGPRX4 (0.52) | ALDH1A1KMT2AHSD17B10KDM4EHPGD | |
| SCHEMBL28302431 | 0.85 | ALDH1A1 (0.41) | ALDH1A1LMNATSHRPOLBKMT2A | |
| SCHEMBL4326103 | 0.85 | ALDH1A1 (0.49) | ALDH1A1LMNATSHRPOLBKMT2A | |
| SCHEMBL31410746 | 0.84 | POLB (0.37) | ALDH1A1LMNAPOLBKMT2AHSD17B10 | |
| SCHEMBL7717040 | 0.83 | ALDH1A1 (0.47) | ALDH1A1LMNATSHRPOLBKMT2A | |
| SCHEMBL12636442 | 0.83 | ALDH1A1 (0.47) | ALDH1A1LMNATSHRPOLBKMT2A |
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-111253404-B | Nitrogen-containing heterocyclic compound and composition, preparation method and application thereof | 上海医药集团股份有限公司 | 2023-05-23 | — | — | CN | disclosed |