Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.56 |
| ▸ | CA12 | O43570 | 3/20 | 0.56 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.56 |
| ▸ | EGFR | P00533 | 2/20 | 0.56 |
| ▸ | FYN | P06241 | 2/20 | 0.56 |
| ▸ | MMP9 | P14780 | 2/20 | 0.56 |
| ▸ | RECQL | P46063 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | CA4 | P22748 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | GMNN | O75496 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
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 | 0.97 | CA2 (0.59) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL29612367 | 0.84 | CA2 (0.43) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL29365257 | 0.78 | ALDH1A1 (0.77) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL5149427 | 0.78 | ALDH1A1 (0.77) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL1235289 | 0.78 | ALDH1A1 (0.77) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL10821068 | 0.78 | ALDH1A1 (0.77) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL30083987 | 0.78 | ALDH1A1 (0.91) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL27734909 | 0.76 | ALDH1A1 (0.71) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL3068690 | 0.76 | ALDH1A1 (0.71) | CA2ALDH1A1LMNAALOX15MAPT | |
| Catechol SCHEMBL367675 | 0.74 | ALDH1A1 (1.00) | CA2ALDH1A1LMNAALOX15MAPT |
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-110114350-B | Substituted guanidine compounds | 宇部兴产株式会社 | 2022-03-04 | — | — | CN | disclosed |