Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | USP8 | P40818 | 1/20 | 0.46 |
| ▸ | USP7 | Q93009 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 3/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Anthracene SCHEMBL29110499 | 0.95 | CA1 (0.59) | CA1CA2ALDH1A1KDM4EGAA | |
| Anthracene SCHEMBL29110489 | 0.92 | CA1 (0.56) | CA1CA2ALDH1A1KDM4EGAA | |
| SCHEMBL149126 | 0.88 | CA1 (0.64) | CA1CA2ALDH1A1KDM4EGAA | |
| SCHEMBL29489128 | 0.88 | CA1 (0.64) | CA1CA2ALDH1A1KDM4EGAA | |
| Naphthalene SCHEMBL27935169 | 0.85 | TSHR (0.55) | CA1CA2ALDH1A1KDM4EGAA | |
| SCHEMBL9804790 | 0.83 | CA1 (0.59) | CA1CA2ALDH1A1KDM4EGAA | |
| SCHEMBL769641 | 0.83 | CA1 (0.59) | CA1CA2ALDH1A1KDM4EGAA | |
| SCHEMBL31251446 | 0.83 | CA1 (0.59) | CA1CA2ALDH1A1KDM4EGAA | |
| Naphthalene SCHEMBL28320819 | 0.82 | TSHR (0.52) | CA1CA2ALDH1A1KDM4EGAA | |
| SCHEMBL21298083 | 0.81 | CA1 (0.52) | CA1CA2ALDH1A1KDM4EGAA |
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-117089083-A | Method for synthesizing low-dimensional heterostructure based on cascade charge transfer organic alloy design | 江西善拓环境科技有限公司 | 2023-11-21 | — | — | CN | disclosed |