Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 8/20 | 0.49 |
| ▸ | RAB9A | P51151 | 8/20 | 0.49 |
| ▸ | HPGD | P15428 | 6/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22360490 | 0.86 | NPC1 (0.42) | SMN1; SMN2THRBNPC1RAB9AHPGD | |
| SCHEMBL22360489 | 0.85 | SMN1; SMN2 (0.45) | SMN1; SMN2THRBNPC1RAB9AHPGD | |
| SCHEMBL22360488 | 0.85 | SMN1; SMN2 (0.50) | SMN1; SMN2THRBNPC1RAB9AHPGD | |
| SCHEMBL22360372 | 0.85 | ANO1 (0.47) | SMN1; SMN2THRBNPC1RAB9AHPGD | |
| SCHEMBL22360378 | 0.85 | RAB9A (0.52) | SMN1; SMN2THRBNPC1RAB9AHPGD | |
| SCHEMBL22360483 | 0.83 | ANO1 (0.51) | SMN1; SMN2THRBNPC1RAB9AHPGD | |
| SCHEMBL22360420 | 0.82 | SMN1; SMN2 (0.55) | SMN1; SMN2NPC1RAB9AHPGDTP53 | |
| SCHEMBL22360375 | 0.80 | MAPT (0.51) | SMN1; SMN2NPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL22360371 | 0.78 | NPC1 (0.48) | SMN1; SMN2NPC1RAB9AHPGDTP53 | |
| SCHEMBL22360386 | 0.78 | CASP3 (0.53) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 |
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-2020164403-A1 | 1,1-DICYANO-OXIME-ETHER COMPOUND AND APPLICATION THEREOF | 沈阳化工大学 | 2020-08-20 | — | — | WO | disclosed |