Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 6/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2B | P41595 | 3/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | GABRE | P78334 | 1/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.36 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.36 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30873752 | 0.81 | TACR1 (0.43) | NR1H2HTR2AHTR2CHTR2BPARP1 | |
| SCHEMBL5333905 | 0.81 | HTR2C (0.47) | NR1H2HTR2AHTR2CHTR2BNR1H3 | |
| SCHEMBL30502301 | 0.80 | HTR2C (0.44) | NR1H2HTR2AHTR2CHTR2BPARP1 | |
| SCHEMBL31556646 | 0.79 | NR1H2 (0.53) | NR1H2HTR2AHTR2CHTR2BNR1H3 | |
| SCHEMBL29773837 | 0.79 | IDO1 (0.43) | NR1H2HTR2AHTR2CHTR2BNR1H3 | |
| SCHEMBL873237 | 0.78 | RAD52 (0.41) | NR1H2HTR2AHTR2CHTR2BPARP1 | |
| SCHEMBL27747418 | 0.77 | NR1H2 (0.38) | NR1H2HTR2AHTR2CHTR2BNR1H3 | |
| SCHEMBL27904545 | 0.77 | NR1H2 (0.38) | NR1H2HTR2AHTR2CHTR2BNR1H3 | |
| SCHEMBL27887751 | 0.77 | NR1H2 (0.38) | NR1H2HTR2AHTR2CHTR2BNR1H3 | |
| SCHEMBL4325057 | 0.77 | NR1H2 (0.49) | NR1H2NR1H3PARP1RXRA |
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-115340523-B | Compound with ALK inhibitory activity and preparation method and application thereof | 盛世泰科生物医药技术(苏州)股份有限公司 | 2023-12-15 | — | — | CN | disclosed |