Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28030776 | 0.80 | EPAS1 (0.33) | — | |
| SCHEMBL15067272 | 0.78 | KDM4E (0.37) | ALDH1A1ALPLKDM4EKMT2AGAA | |
| SCHEMBL8414710 | 0.77 | GAA (0.47) | ALDH1A1HTTKDM4EPOLBGAA | |
| SCHEMBL233007 | 0.76 | ALDH1A1 (0.44) | ALDH1A1KDM4EPOLBGAA | |
| SCHEMBL15067412 | 0.75 | KDM4E (0.32) | KDM4EKMT2A | |
| SCHEMBL9740475 | 0.75 | PTPN1 (0.35) | KDM4EKMT2APOLB | |
| SCHEMBL15067717 | 0.75 | KDM4E (0.32) | ALDH1A1KDM4EKMT2A | |
| SCHEMBL27962934 | 0.73 | ALDH1A1 (0.41) | ALDH1A1HTTPOLBPKM | |
| SCHEMBL15066779 | 0.73 | KDM4E (0.36) | ALDH1A1ALPLKDM4EKMT2AGAA | |
| SCHEMBL5844581 | 0.72 | EPAS1 (0.35) | — |
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-105008378-A | Reaction catalyst for cross coupling and method for manufacturing aromatic compound | HOKKO CHEM IND CO | 2015-10-28 | — | — | CN | disclosed |