Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FLT3 | P36888 | 8/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 8/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL30009067 | 0.86 | ALK (0.46) | FLT3ALK | |
| SCHEMBL29818492 | 0.82 | FLT3 (0.47) | FLT3ALK | |
| SCHEMBL15821395 | 0.82 | FLT3 (0.47) | FLT3ALK | |
| SCHEMBL29940783 | 0.75 | CA1 (0.50) | BCHECES1MAOAALDH1A1 | |
| SCHEMBL6847079 | 0.70 | RAB9A (0.46) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL17113665 | 0.69 | ELANE (0.47) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL30848637 | 0.68 | MAOA (0.47) | BCHECES1MAOAALDH1A1 | |
| SCHEMBL30009136 | 0.67 | MAPK10 (0.41) | FLT3ALK | |
| SCHEMBL6577996 | 0.64 | CA12 (0.45) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL22541409 | 0.64 | PARP1 (0.44) | GABRA1GABRG2GABRB3GABRA5GABRA3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022237813-A1 | COMPOUND HAVING ALK INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF | 盛世泰科生物医药技术(苏州)有限公司 | 2022-11-17 | — | — | WO | disclosed |