Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28372098 | 0.81 | PLA2G7 (0.41) | KMT2APLA2G7MAPTTSHRTDP1 | |
| SCHEMBL9486868 | 0.78 | KMT2A (0.51) | KMT2AMEN1MAPTTSHRTDP1 | |
| Nitrous Acid SCHEMBL28033154 | 0.76 | NFE2L2 (0.41) | KMT2AMEN1MAPTTSHRTDP1 | |
| SCHEMBL10897959 | 0.75 | AKT1 (0.42) | KMT2AMEN1MAPTTSHRTDP1 | |
| SCHEMBL11330623 | 0.75 | AKT1 (0.42) | KMT2AMEN1MAPTTSHRTDP1 | |
| SCHEMBL4238493 | 0.74 | NFE2L2 (0.46) | KMT2AMEN1MAPTTSHRTDP1 | |
| SCHEMBL3809749 | 0.74 | NFE2L2 (0.46) | KMT2AMEN1MAPTTSHRTDP1 | |
| SCHEMBL1536420 | 0.74 | NFE2L2 (0.46) | KMT2AMEN1MAPTTSHRTDP1 | |
| SCHEMBL4238491 | 0.74 | NFE2L2 (0.46) | KMT2AMEN1MAPTTSHRTDP1 | |
| SCHEMBL1536421 | 0.74 | NFE2L2 (0.46) | KMT2AMEN1MAPTTSHRTDP1 |
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-104936963-A | Thioether derivatives as protein kinase inhibitors | KTB TUMORFORSCHUNGS GMBH | 2015-09-23 | — | — | CN | disclosed |