Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 5/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 7/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22360371 | 0.86 | NPC1 (0.48) | TP53POLBHPGDSMN1; SMN2TSHR | |
| SCHEMBL22360374 | 0.86 | RAB9A (0.48) | TP53POLBHPGDSMN1; SMN2TSHR | |
| SCHEMBL22360380 | 0.86 | POLB (0.39) | TP53POLBHPGDSMN1; SMN2TSHR | |
| SCHEMBL22360373 | 0.86 | PTK2 (0.45) | TP53POLBSMN1; SMN2TSHRNPC1 | |
| SCHEMBL22360379 | 0.85 | POLB (0.49) | TP53POLBHPGDSMN1; SMN2NPC1 | |
| SCHEMBL22360420 | 0.85 | SMN1; SMN2 (0.55) | TP53POLBHPGDSMN1; SMN2TSHR | |
| SCHEMBL22360492 | 0.83 | KDM4E (0.45) | TP53POLBHPGDSMN1; SMN2NPC1 | |
| SCHEMBL22360494 | 0.80 | L3MBTL1 (0.39) | POLBHPGDSMN1; SMN2TSHRLMNA | |
| SCHEMBL22360403 | 0.79 | SMN1; SMN2 (0.55) | TP53POLBHPGDSMN1; SMN2TSHR | |
| SCHEMBL22360419 | 0.78 | NOTUM (0.38) | POLBHPGDSMN1; SMN2LMNANPC1 |
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 |