Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRC | P08575 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27919084 | 0.80 | PTPRC (0.56) | PTPRCCES2CES1TP53ALDH1A1 | |
| SCHEMBL7451869 | 0.80 | PTPRC (0.56) | PTPRCCES2CES1TP53ALDH1A1 | |
| SCHEMBL4369637 | 0.78 | PTPRC (0.54) | PTPRCCES2CES1TP53ALDH1A1 | |
| SCHEMBL6622555 | 0.77 | PTPRC (0.59) | PTPRCCES2CES1TP53ALDH1A1 | |
| SCHEMBL27963785 | 0.77 | PTPRC (0.59) | PTPRCCES2CES1TP53ALDH1A1 | |
| SCHEMBL1645746 | 0.77 | PTPRC (0.59) | PTPRCCES2CES1TP53ALDH1A1 | |
| SCHEMBL27869010 | 0.77 | ALDH1A1 (0.53) | TP53ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL4656742 | 0.77 | PTPRC (0.52) | PTPRCCES2CES1TP53ALDH1A1 | |
| SCHEMBL27901490 | 0.76 | PTPRC (0.43) | PTPRCTP53ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL245910 | 0.76 | PTPRC (0.57) | PTPRCCES2CES1TP53ALDH1A1 |
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-103068806-A | 1,4,5,6-tetrahydro-pyrimidin-2-ylamine compounds | SIENA BIOTECH SPA | 2013-04-24 | — | — | CN | disclosed |