Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | BCHE | P06276 | 5/20 | 0.50 |
| ▸ | ACHE | P22303 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.47 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.47 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.47 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.47 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28598041 | 0.84 | BCHE (0.64) | HSD17B10KDM4EALDH1A1HPGDBCHE | |
| SCHEMBL31121558 | 0.82 | KDM4E (0.47) | HSD17B10KDM4EALDH1A1HPGDADORA2A | |
| SCHEMBL28304791 | 0.82 | BCHE (0.63) | HSD17B10KDM4EALDH1A1HPGDBCHE | |
| SCHEMBL28179850 | 0.80 | KDM4E (0.47) | HSD17B10KDM4EALDH1A1HPGDADORA2A | |
| SCHEMBL28151465 | 0.79 | KDM4E (0.50) | HSD17B10KDM4EALDH1A1HPGDADORA2A | |
| SCHEMBL9593576 | 0.78 | ALDH1A1 (0.63) | HSD17B10KDM4EALDH1A1HPGDADORA2A | |
| SCHEMBL17351540 | 0.78 | KDM4E (0.71) | HSD17B10KDM4EALDH1A1HPGDADORA2A | |
| SCHEMBL15572586 | 0.78 | KDM4E (0.46) | HSD17B10KDM4EALDH1A1HPGDADORA2A | |
| SCHEMBL12884366 | 0.77 | KDM4E (0.67) | HSD17B10KDM4EALDH1A1HPGDADORA2A | |
| SCHEMBL17351373 | 0.77 | KDM4E (0.97) | HSD17B10KDM4EALDH1A1HPGDADORA2A |
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-117088921-A | Metal complexes of bicycloalkyl-pyridine skeleton, intermediates, synthesis and catalyst compositions | 河北农业大学 | 2023-11-21 | — | — | CN | disclosed |