Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.41 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL30543203 | 1.00 | TLR8 (0.41) | TLR8GPBAR1MAPK1CYSLTR2CYSLTR1 | |
| SCHEMBL30746985 | 0.99 | GPBAR1 (0.41) | TLR8GPBAR1MAPK1CYSLTR2CYSLTR1 | |
| Hydrochloric Acid SCHEMBL30543224 | 0.97 | GPBAR1 (0.40) | TLR8GPBAR1MAPK1CYSLTR2CYSLTR1 | |
| SCHEMBL8218133 | 0.94 | TLR8 (0.38) | TLR8GPBAR1MAPK1CYSLTR2CYSLTR1 | |
| SCHEMBL30746954 | 0.91 | TLR8 (0.41) | TLR8GPBAR1MAPK1CYSLTR2CYSLTR1 | |
| SCHEMBL30749429 | 0.83 | NR1I2 (0.35) | SMN1; SMN2NR1I2 | |
| SCHEMBL30402217 | 0.82 | GPBAR1 (0.42) | TLR8GPBAR1MAPK1CYSLTR2CYSLTR1 | |
| Hydrochloric Acid SCHEMBL30749395 | 0.82 | PDE5A (0.35) | SMN1; SMN2NR1I2 | |
| SCHEMBL30543260 | 0.81 | KDM4E (0.38) | TLR8TP53TSHRMEN1ALDH1A1 | |
| SCHEMBL3021081 | 0.81 | GPBAR1 (0.41) | TLR8GPBAR1MAPK1CYSLTR2CYSLTR1 |
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-115996912-A | Iminothiolanone inhibitors of ENPP1 | 沃拉斯查疗法公司 | 2023-04-21 | — | — | CN | disclosed |