Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | SI | P14410 | 2/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | HCAR2 | Q8TDS4 | 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 | |
|---|---|---|---|---|
| Butanone SCHEMBL27662174 | 0.97 | ALDH1A1 (0.50) | ALDH1A1TDP1LMNAHSD17B10SOAT1 | |
| Ethoxycarbonyl Group SCHEMBL9528444 | 0.89 | — | — | |
| Benzene SCHEMBL27657340 | 0.89 | ALDH1A1 (0.42) | ALDH1A1TDP1LMNAHSD17B10SOAT1 | |
| Ethoxycarbonyl Group SCHEMBL4631753 | 0.86 | — | — | |
| Ethoxycarbonyl Group SCHEMBL27662161 | 0.84 | ALDH1A1 (0.38) | ALDH1A1TDP1LMNAHSD17B10SOAT1 | |
| Propionic Acid SCHEMBL28065864 | 0.84 | FFAR3 (0.53) | ALDH1A1TDP1LMNAHSD17B10SOAT1 | |
| Ethoxycarbonyl Group SCHEMBL7400598 | 0.83 | — | — | |
| Ethoxycarbonyl Group SCHEMBL3225173 | 0.83 | — | — | |
| Ethoxycarbonyl Group SCHEMBL1332384 | 0.83 | — | — | |
| Ethoxycarbonyl Group SCHEMBL5306888 | 0.83 | ALDH1A1 (0.38) | ALDH1A1TDP1TSHR |
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-109071504-A | Inhibitors of receptor interacting protein kinase 1 | 戴纳立制药公司 | 2018-12-21 | — | — | CN | disclosed |