Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31451156 | 0.85 | RIPK1 (0.42) | IDO1TSHRALDH1A1RIPK1TAAR1 | |
| SCHEMBL30912296 | 0.85 | FDPS (0.53) | HSPA5IDO1TSHRALDH1A1TDP1 | |
| SCHEMBL30915206 | 0.82 | GABRA1 (0.45) | GABRA1GABRB2TSHRALDH1A1TDP1 | |
| Boric Acid SCHEMBL38657534 | 0.80 | RIPK1 (0.40) | IDO1ALDH1A1MPORIPK1TAAR1 | |
| SCHEMBL30440759 | 0.80 | PDK2 (0.40) | ALDH1A1AKR1B1MEN1KMT2ALMNA | |
| SCHEMBL30440526 | 0.80 | TRIM24 (0.44) | GABRA1GABRB2TSHRALDH1A1TDP1 | |
| SCHEMBL11444579 | 0.78 | SLC6A2 (0.54) | TSHRALDH1A1TAAR1CYP2D6HIF1A | |
| Boric Acid SCHEMBL20483436 | 0.78 | TRIM24 (0.41) | GABRA1GABRB2TSHRALDH1A1TDP1 | |
| Boric Acid SCHEMBL30476757 | 0.76 | TSHR (0.30) | TSHR | |
| SCHEMBL30367535 | 0.76 | TSHR (0.45) | GABRA1GABRB2TSHRALDH1A1FDPS |
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-114685506-A | Organic compound, light-emitting device, display substrate, and display device | 京东方科技集团股份有限公司 | 2022-07-01 | — | — | CN | disclosed |