Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 3/20 | 0.36 |
| ▸ | LPO | P22079 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | FDPS | P14324 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | THRA | P10827 | 1/20 | 0.31 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | PDE6D | O43924 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28874204 | 0.79 | THRB (0.33) | THRB | |
| SCHEMBL28386445 | 0.78 | CHRNB2 (0.40) | CHRNB2CHRNA4LPOKMT2AMEN1 | |
| SCHEMBL1682004 | 0.78 | CHRNB2 (0.40) | CHRNB2CHRNA4LPOKMT2AMEN1 | |
| SCHEMBL6673530 | 0.77 | CHRNB2 (0.39) | CHRNB2CHRNA4LPOKMT2AMEN1 | |
| SCHEMBL28324901 | 0.73 | SMN1; SMN2 (0.40) | THRBKMT2AMEN1FDPSNPC1 | |
| Hydrochloric Acid SCHEMBL30495381 | 0.72 | THRB (0.31) | THRBKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2285950 | 0.72 | KMT2A (0.39) | CHRNB2CHRNA4LPOKMT2AFDPS | |
| Acrylic Acid Ethyl Ester SCHEMBL28308647 | 0.71 | LPO (0.40) | THRBLPOKMT2ANPC1RAB9A | |
| SCHEMBL28761793 | 0.70 | THRB (0.35) | THRBKMT2AMEN1SMN1; SMN2THRA | |
| SCHEMBL2804720 | 0.70 | KMT2A (0.52) | KMT2ASMN1; SMN2ALDH1A1 |
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-110247042-A | A kind of interface modification method of lithium battery composite single crystal positive electrode | 中国科学院化学研究所 | 2019-09-17 | — | — | CN | disclosed |