Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 6/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 6/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 5/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 5/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25952871 | 0.74 | TAAR1 (0.40) | TSHRCYP2D6ALDH1A1CYP2C19KCNN4 | |
| SCHEMBL27668560 | 0.74 | CYP2D6 (0.38) | TSHRCYP2D6ALDH1A1CYP2C19HSD17B10 | |
| SCHEMBL21534536 | 0.74 | TAAR1 (0.40) | TSHRCYP2D6ALDH1A1CYP2C19KCNN4 | |
| SCHEMBL31348864 | 0.73 | GRIN1 (0.46) | CYP2D6ALDH1A1CYP2C19HSD17B10GRIN1 | |
| SCHEMBL24399780 | 0.72 | CYP2D6 (0.37) | CYP2D6ALDH1A1CYP2C19HSD17B10KCNN4 | |
| SCHEMBL10325859 | 0.69 | CYP2D6 (0.45) | CYP2D6ALDH1A1CYP2C19HSD17B10GRIN1 | |
| SCHEMBL6284917 | 0.69 | GRIN1 (0.44) | CYP2D6ALDH1A1CYP2C19HSD17B10GRIN1 | |
| SCHEMBL18671994 | 0.69 | KMT2A (0.39) | TSHRCYP2D6ALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL9579235 | 0.69 | RIPK1 (0.42) | CYP2D6ALDH1A1CYP2C19HSD17B10GRIN1 | |
| SCHEMBL3390152 | 0.69 | RIPK1 (0.38) | CYP2D6ALDH1A1CYP2C19KCNH2OPRK1 |
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-113372631-A | Rubber-plastic composite foaming material | 钜奕科技有限公司 | 2021-09-10 | — | — | CN | disclosed |