Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.44 |
| ▸ | RELA | Q04206 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | SCD | O00767 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29033642 | 0.87 | CASR (0.46) | MAPTKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL29033640 | 0.77 | CASR (0.46) | MAPTKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL29033658 | 0.76 | CASR (0.46) | MAPTKMT2AMEN1LMNAALDH1A1 | |
| SCHEMBL29033625 | 0.74 | CASR (0.43) | MAPTKMT2AMEN1NPC1LMNA | |
| SCHEMBL30731274 | 0.72 | CYP1A2 (0.58) | MAPTKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL16871130 | 0.70 | CASR (0.46) | MAPTKMT2AMEN1LMNAALDH1A1 | |
| SCHEMBL799881 | 0.69 | CYP1A2 (0.61) | MAPTKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL9888403 | 0.69 | SMN1; SMN2 (0.48) | SMN1; SMN2LMNAALDH1A1CYP2C19KDM4E | |
| SCHEMBL19435592 | 0.68 | CYP1A2 (0.59) | MAPTKMT2AMEN1RAB9ANPC1 | |
| SCHEMBL30778224 | 0.68 | ALOX5 (0.44) | KMT2AMEN1SMN1; SMN2ALDH1A1CYP1A2 |
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-117603027-A | Olefin difunctional method and delta-trifluoromethyl ketone product prepared by same | 重庆理工大学 | 2024-02-27 | — | — | CN | disclosed |