Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 8/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 6/20 | 0.61 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL396812 | 0.88 | CES1 (0.48) | GSK3BPTPN1MDM2TDP1CES1 | |
| SCHEMBL28106996 | 0.80 | GSK3B (0.70) | GSK3BPTPN1MDM2TDP1CES1 | |
| SCHEMBL19331717 | 0.78 | GSK3B (1.00) | GSK3BPTPN1TDP1CES1MAPK1 | |
| SCHEMBL7621 | 0.78 | GSK3B (1.00) | GSK3BPTPN1TDP1CES1MAPK1 | |
| SCHEMBL18849535 | 0.78 | GSK3B (1.00) | GSK3BPTPN1TDP1CES1MAPK1 | |
| Bromide SCHEMBL28774450 | 0.76 | GSK3B (0.95) | GSK3BPTPN1TDP1CES1MAPK1 | |
| Methane SCHEMBL7161301 | 0.76 | GSK3B (0.95) | GSK3BPTPN1TDP1CES1MAPK1 | |
| Fluoride SCHEMBL27997580 | 0.76 | GSK3B (0.95) | GSK3BPTPN1TDP1CES1MAPK1 | |
| Water SCHEMBL28144749 | 0.76 | GSK3B (0.95) | GSK3BPTPN1TDP1CES1MAPK1 | |
| Hydrogen Sulfide SCHEMBL7496567 | 0.76 | GSK3B (0.95) | GSK3BPTPN1TDP1CES1MAPK1 |
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-103936819-B | Hepatitis c virus inhibitors | 百时美施贵宝公司 | 2016-11-16 | — | — | CN | disclosed |