Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.53 |
| ▸ | CA2 | P00918 | 7/20 | 0.53 |
| ▸ | CA9 | Q16790 | 6/20 | 0.53 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CTRC | Q99895 | 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 | |
|---|---|---|---|---|
| SCHEMBL30112897 | 1.00 | CA12 (0.53) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL6679817 | 0.75 | CA12 (0.60) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL7203706 | 0.75 | CA12 (0.60) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL14337425 | 0.72 | CA12 (0.56) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL30528139 | 0.72 | CA12 (0.56) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL30528140 | 0.72 | CA12 (0.56) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL11331441 | 0.72 | CA12 (0.56) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL30416505 | 0.72 | CA12 (0.51) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL23495453 | 0.71 | CA12 (0.55) | CA12CA2CA9SIRT2KDM4E | |
| SCHEMBL1436003 | 0.71 | CA12 (0.55) | CA12CA2CA9SIRT2KDM4E |
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-112010874-B | Copper (I) complex based on butanone and salicylidene amino triazole Schiff base and synthesis method thereof | 柳州工学院 | 2023-02-03 | — | — | CN | disclosed |