Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA7 | P43166 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL105204 | 0.98 | CA1 (0.48) | CA1CA2CA7CA9CA12 | |
| SCHEMBL28053489 | 0.95 | CA1 (0.46) | CA1CA2CA7CA9CA12 | |
| SCHEMBL27274696 | 0.93 | CA1 (0.43) | CA1CA2CA7CA9CA12 | |
| Magnesium Chloride Anhydrous SCHEMBL28224231 | 0.89 | CA1 (0.40) | CA1CA2CA7CA9CA12 | |
| SCHEMBL27493759 | 0.89 | CA1 (0.40) | CA1CA2CA7CA9CA12 | |
| SCHEMBL29242304 | 0.86 | CA1 (0.37) | CA1CA2CA7CA9CA12 | |
| SCHEMBL8047364 | 0.80 | ALDH1A3 (0.39) | CA1CA2CA7CA9CA12 | |
| SCHEMBL4820299 | 0.80 | ESR2 (0.48) | CA1CA2CA7CA9CA12 | |
| SCHEMBL7688834 | 0.79 | CA12 (0.33) | CA1CA2CA7CA9CA12 | |
| SCHEMBL1069758 | 0.79 | MAPT (0.37) | CA1CA2CA7CA9CA12 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108178724-A | The preparation method of compound | 四川大学 | 2018-06-19 | — | — | CN | claimed |
| CN-1178919-C | Synthesis of intermediates useful in preparing tricyclic compounds | ���鹫˾ | 2004-12-08 | — | — | CN | claimed |
| CN-1257484-A | Synthesis of intermediates useful in preparing tricyclic compounds | SCHERING CORP (US) | 2000-06-21 | — | — | CN | claimed |
| CN-108178724-A | The preparation method of compound | 四川大学 | 2018-06-19 | — | — | CN | disclosed |
| CN-1178919-C | Synthesis of intermediates useful in preparing tricyclic compounds | ���鹫˾ | 2004-12-08 | — | — | CN | disclosed |
| CN-1257484-A | Synthesis of intermediates useful in preparing tricyclic compounds | SCHERING CORP (US) | 2000-06-21 | — | — | CN | disclosed |