Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28104665 | 0.80 | ALDH1A1 (0.40) | CA1CA2CA9KMT2A | |
| SCHEMBL1648626 | 0.80 | KMT2A (0.54) | HDAC1HDAC6CA12CA1CA2 | |
| SCHEMBL24169594 | 0.79 | HDAC1 (0.59) | HDAC1HDAC6CA12CA1CA2 | |
| SCHEMBL1648693 | 0.77 | CA2 (0.36) | HDAC1HDAC6CA12CA1CA2 | |
| SCHEMBL14352049 | 0.76 | HDAC1 (0.57) | HDAC1HDAC6CA12CA1CA2 | |
| SCHEMBL22002417 | 0.76 | HDAC1 (0.57) | HDAC1HDAC6CA12CA1CA2 | |
| SCHEMBL5837680 | 0.76 | HDAC1 (0.57) | HDAC1HDAC6CA12CA1CA2 | |
| Methyl 2,6-Dimethoxybenzoate SCHEMBL2095636 | 0.75 | CA12 (0.65) | HDAC1HDAC6CA12CA1CA2 | |
| SCHEMBL10741549 | 0.72 | HSP90AA1 (0.56) | HDAC1HDAC6CA12CA1CA2 | |
| SCHEMBL28104572 | 0.72 | HDAC1 (0.45) | HDAC1HDAC6KMT2AMAPT |
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-102639494-B | Sulphones and preparation and application thereof | 扎夫根公司 | 2016-11-09 | — | — | CN | disclosed |