Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28890102 | 0.83 | KMT2A (0.58) | KMT2APTGS1PTGS2ALDH1A1HTT | |
| SCHEMBL1417280 | 0.78 | THRB (0.39) | KMT2AALDH1A1HTTLMNASLC6A3 | |
| SCHEMBL6282856 | 0.78 | THRB (0.39) | KMT2AALDH1A1HTTLMNASLC6A3 | |
| SCHEMBL14626670 | 0.75 | KMT2A (0.62) | KMT2APTGS1PTGS2ALDH1A1HTT | |
| SCHEMBL25836630 | 0.75 | KMT2A (0.62) | KMT2APTGS1PTGS2ALDH1A1HTT | |
| SCHEMBL12761433 | 0.75 | THRB (0.39) | ALDH1A1HTTCYP3A4LMNA | |
| SCHEMBL11073226 | 0.74 | KMT2A (0.60) | KMT2APTGS1PTGS2ALDH1A1CYP3A4 | |
| SCHEMBL9683887 | 0.74 | KMT2A (0.60) | KMT2APTGS1PTGS2ALDH1A1CYP3A4 | |
| SCHEMBL12269294 | 0.73 | AKR1C3 (0.45) | KMT2APTGS1PTGS2ALDH1A1MEN1 | |
| SCHEMBL18165406 | 0.73 | KMT2A (0.63) | KMT2APTGS1PTGS2ALDH1A1CYP26A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4448980-A | BY CARBONYLATION WITH BIFLUORIDE CATALYSTS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-05-15 | — | — | US | disclosed |