Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 15/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.76 |
| ▸ | HPGD | P15428 | 8/20 | 0.76 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.76 |
| ▸ | MAPT | P10636 | 7/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | GRM5 | P41594 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL19740957 | 1.00 | KDM4E (0.76) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL13298471 | 0.85 | KDM4E (0.66) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL1323213 | 0.82 | KDM4E (0.72) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL29229877 | 0.81 | KDM4E (0.72) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL30968519 | 0.77 | KDM4E (0.58) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL1161982 | 0.77 | KDM4E (0.58) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL19741371 | 0.75 | KDM4E (0.56) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL14661244 | 0.74 | ALDH1A1 (0.45) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL14661224 | 0.74 | ALDH1A1 (0.42) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL21027617 | 0.72 | KDM4E (0.49) | KDM4EALDH1A1HPGDHSD17B10MAPT |
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-113453762-B | Pentacyclic heterocyclic compounds | 卫材R&D管理有限公司 | 2024-06-07 | — | — | CN | disclosed |