Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5836723 | 1.00 | KMT2A (0.55) | KMT2ALMNAPTGS1PTGS2MEN1 | |
| SCHEMBL5835956 | 0.93 | KMT2A (0.51) | KMT2ALMNAPTGS1PTGS2MEN1 | |
| SCHEMBL5835964 | 0.92 | KMT2A (0.50) | KMT2ALMNAPTGS1PTGS2MEN1 | |
| SCHEMBL16870979 | 0.85 | KMT2A (0.53) | KMT2ALMNAPTGS1PTGS2MEN1 | |
| SCHEMBL9687500 | 0.83 | MMP8 (0.49) | KMT2ALMNAMEN1TSHRSLC6A3 | |
| SCHEMBL7218494 | 0.82 | HDAC4 (0.44) | KMT2ALMNAPTGS1PTGS2ALDH1A1 | |
| SCHEMBL7218493 | 0.82 | HDAC4 (0.44) | KMT2ALMNAPTGS1PTGS2ALDH1A1 | |
| SCHEMBL9563164 | 0.80 | LMNA (0.53) | KMT2ALMNAALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL9686992 | 0.80 | KMT2A (0.47) | KMT2ALMNAPTGS1PTGS2MEN1 | |
| SCHEMBL5836538 | 0.80 | LMNA (0.51) | LMNACYP2C19 |
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-102731572-B | Containing the Phosphine ligands of perfluoroalkyl, its preparation method, application and metal complex | SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2015-08-05 | — | — | CN | disclosed |