Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | HTR5A | P47898 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL2357949 | 1.00 | HDAC1 (0.55) | HDAC1HDAC6KDM4ERAB9AHTR2A | |
| SCHEMBL9615137 | 0.88 | HTR2A (0.55) | HDAC1HDAC6KDM4ERAB9AHTR2A | |
| Trifluoroacetic Acid SCHEMBL31078319 | 0.88 | HDAC6 (0.53) | HDAC1HDAC6KDM4ERAB9AHTR2A | |
| Hydrochloric Acid SCHEMBL9696491 | 0.87 | KDM4E (0.56) | HDAC1HDAC6KDM4ERAB9AHTR2A | |
| SCHEMBL176660 | 0.84 | SIRT2 (0.66) | HDAC1HDAC6KDM4ERAB9AHTR2A | |
| SCHEMBL2192008 | 0.82 | HDAC1 (0.56) | HDAC1HDAC6KDM4EHTR2AHTR2C | |
| SCHEMBL8025072 | 0.82 | HDAC1 (0.69) | HDAC1HDAC6CA1CA2ALDH1A1 | |
| SCHEMBL8106969 | 0.82 | HDAC1 (0.53) | HDAC1HDAC6KDM4EHTR2AHTR2C | |
| SCHEMBL2187576 | 0.81 | HDAC1 (0.55) | HDAC1HDAC6KDM4EHTR2AHTR2C | |
| SCHEMBL8100771 | 0.81 | HDAC1 (0.52) | HDAC1HDAC6KDM4EHTR2AHTR2C |
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-117946031-A | Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors | 北京大学 | 2024-04-30 | — | — | CN | disclosed |