Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | GABRP | O00591 | 2/20 | 0.35 |
| ▸ | GABRD | O14764 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.35 |
| ▸ | GABRE | P78334 | 2/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19211020 | 0.80 | DYRK1A (0.35) | ROCK2ROCK1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30038860 | 0.78 | TSHR (0.46) | TSHRMAPTROCK2ROCK1ALDH1A1 | |
| SCHEMBL18372881 | 0.78 | TSHR (0.46) | TSHRMAPTROCK2ROCK1ALDH1A1 | |
| SCHEMBL3120925 | 0.78 | DYRK1A (0.34) | ROCK2ROCK1 | |
| SCHEMBL9906869 | 0.74 | NAMPT (0.45) | TSHRMAPTROCK2ROCK1ALDH1A1 | |
| SCHEMBL29549777 | 0.74 | NAMPT (0.45) | TSHRMAPTROCK2ROCK1ALDH1A1 | |
| SCHEMBL30119558 | 0.71 | ALDH1A1 (0.46) | MAPTALDH1A1NPSR1GABRPGABRD | |
| SCHEMBL1894052 | 0.71 | DYRK1A (0.46) | TSHRALDH1A1KDM4ELMNAKMT2A | |
| SCHEMBL4805737 | 0.71 | SMYD3 (0.51) | TSHRMAPTROCK2ROCK1ALDH1A1 | |
| SCHEMBL30174393 | 0.71 | DYRK1A (0.46) | TSHRALDH1A1KDM4ELMNAKMT2A |
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-108884096-B | Spiroindolinones as DDR1 inhibitors | 豪夫迈·罗氏有限公司 | 2022-03-22 | — | — | CN | disclosed |