Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP14 | P50281 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 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 | |
|---|---|---|---|---|
| SCHEMBL11236986 | 0.78 | CA12 (0.51) | CA12CA14CA2MMP2MMP9 | |
| SCHEMBL29067530 | 0.77 | KMT2A (0.38) | MEN1KMT2AALDH1A1MAPTGAA | |
| SCHEMBL29067537 | 0.77 | MAPT (0.41) | MEN1KMT2AALDH1A1KDM4EMAPT | |
| SCHEMBL29067546 | 0.77 | KCNQ2 (0.38) | MMP2MMP9MEN1KMT2AALDH1A1 | |
| SCHEMBL4970622 | 0.75 | CA12 (0.51) | CA12CA14CA2MMP2MMP9 | |
| SCHEMBL4970631 | 0.75 | CA12 (0.51) | CA12CA14CA2MMP2MMP9 | |
| SCHEMBL29067526 | 0.73 | KDM4E (0.42) | CA12CA2MEN1KMT2AALDH1A1 | |
| SCHEMBL11767973 | 0.72 | MEN1 (0.49) | CA12CA14CA2MMP2MMP9 | |
| SCHEMBL9518994 | 0.72 | CA12 (0.45) | CA12CA14CA2MMP2MMP9 | |
| SCHEMBL29067518 | 0.72 | TDP1 (0.40) | CA12MEN1KMT2AALDH1A1KDM4E |
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-116462598-A | Allyl arylamine compound and preparation method and application thereof | 成都市第二人民医院 | 2023-07-21 | — | — | CN | disclosed |