Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.48 |
| ▸ | CA6 | P23280 | 5/20 | 0.48 |
| ▸ | CA7 | P43166 | 5/20 | 0.48 |
| ▸ | CA9 | Q16790 | 5/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA4 | P22748 | 4/20 | 0.48 |
| ▸ | CA5A | P35218 | 4/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | CA3 | P07451 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28310985 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL27783359 | 0.84 | — | — | |
| Trientine SCHEMBL29128785 | 0.79 | CA12 (0.55) | CA12CA6CA7CA9CA14 | |
| Thiourea SCHEMBL3345993 | 0.75 | CA12 (0.67) | CA12CA6CA7CA9CA14 | |
| SCHEMBL27701400 | 0.75 | KDM4A (0.42) | CA12CA6CA7CA9CA14 | |
| Trientine SCHEMBL29003404 | 0.74 | CA12 (0.61) | CA12CA6CA7CA9CA14 | |
| SCHEMBL28920597 | 0.74 | CA12 (0.61) | CA12CA6CA7CA9CA14 | |
| SCHEMBL3360351 | 0.73 | CA12 (0.62) | CA12CA6CA7CA9CA14 | |
| SCHEMBL11171595 | 0.71 | CA12 (0.59) | CA12CA6CA7CA9CA14 | |
| SCHEMBL10336116 | 0.71 | CA12 (0.59) | CA12CA6CA7CA9CA14 |
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-115975504-A | Composite passivator for inhibiting oxidation of pyrite and preparation method and application thereof | 成都理工大学 | 2023-04-18 | — | — | CN | disclosed |