Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 9/20 | 0.53 |
| ▸ | CA2 | P00918 | 9/20 | 0.53 |
| ▸ | CA9 | Q16790 | 8/20 | 0.53 |
| ▸ | CA12 | O43570 | 3/20 | 0.53 |
| ▸ | CA7 | P43166 | 3/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.53 |
| ▸ | CA3 | P07451 | 2/20 | 0.53 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA6 | P23280 | 2/20 | 0.53 |
| ▸ | CA5A | P35218 | 2/20 | 0.53 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.53 |
| ▸ | RECQL | P46063 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6273927 | 0.96 | CA1 (0.53) | CA1CA2CA9CA12CA7 | |
| SCHEMBL2786484 | 0.94 | CA1 (0.55) | CA1CA2CA9CA12CA7 | |
| Decanol SCHEMBL11435759 | 0.94 | CA1 (0.55) | CA1CA2CA9CA12CA7 | |
| Octanol SCHEMBL11435654 | 0.94 | CA1 (0.55) | CA1CA2CA9CA12CA7 | |
| Ammonia Solution, Strong SCHEMBL21065513 | 0.92 | CA1 (0.53) | CA1CA2CA9CA12CA7 | |
| SCHEMBL6818150 | 0.90 | CA1 (0.55) | CA1CA2CA9CA12CA7 | |
| SCHEMBL28089767 | 0.90 | CA1 (0.55) | CA1CA2CA9CA12CA7 | |
| SCHEMBL28532538 | 0.90 | CA1 (0.55) | CA1CA2CA9CA12CA7 | |
| SCHEMBL10603592 | 0.90 | CA1 (0.55) | CA1CA2CA9CA12CA7 | |
| SCHEMBL11221630 | 0.90 | CA1 (0.55) | CA1CA2CA9CA12CA7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114364773-A | Aromatic oil mixture | 西姆莱斯股份公司 | 2022-04-15 | — | — | CN | disclosed |
| CN-113710331-A | Antimicrobial mixture | 西姆莱斯股份公司 | 2021-11-26 | — | — | CN | disclosed |