Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Catechol SCHEMBL29612370 | 0.86 | CA2 (0.59) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL29489384 | 0.86 | ALDH1A1 (0.59) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL29414907 | 0.84 | CA2 (0.56) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL132726 | 0.69 | ALDH1A1 (0.77) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL10821068 | 0.69 | ALDH1A1 (0.77) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL28985421 | 0.69 | ALDH1A1 (0.77) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL1235289 | 0.69 | ALDH1A1 (0.77) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL5149427 | 0.69 | ALDH1A1 (0.77) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL29365257 | 0.69 | ALDH1A1 (0.77) | CA2LMNAMAPTALDH1A1ALOX15 | |
| Catechol SCHEMBL3068690 | 0.67 | ALDH1A1 (0.71) | CA2LMNAMAPTALDH1A1ALOX15 |
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-112687880-B | Lithium-rich material, and modification method and application thereof | 山东大学 | 2022-06-14 | — | — | CN | disclosed |