Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28637947 | 1.00 | P2RX7 (0.54) | P2RX7NPC1RAB9AGLAL3MBTL1 | |
| SCHEMBL28653249 | 0.87 | CA2 (0.47) | L3MBTL1POLBALDH1A1CA12CA1 | |
| SCHEMBL28632385 | 0.87 | CA2 (0.47) | L3MBTL1POLBALDH1A1CA12CA1 | |
| SCHEMBL28643460 | 0.86 | RAB9A (0.52) | P2RX7NPC1RAB9AL3MBTL1POLB | |
| SCHEMBL28053554 | 0.79 | HDAC1 (0.53) | P2RX7NPC1RAB9APOLBALDH1A1 | |
| SCHEMBL28621729 | 0.79 | HDAC1 (0.50) | NPC1RAB9AALDH1A1HDAC3HDAC4 | |
| SCHEMBL28638771 | 0.79 | HDAC1 (0.50) | NPC1RAB9AALDH1A1HDAC3HDAC4 | |
| SCHEMBL28261748 | 0.79 | HDAC1 (0.50) | NPC1RAB9AALDH1A1HDAC3HDAC4 | |
| SCHEMBL28645125 | 0.78 | HDAC3 (0.53) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL28625843 | 0.78 | HDAC3 (0.53) | HDAC3HDAC4HDAC1HDAC7HDAC2 |
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-108997233-A | A kind of synthetic method of (Z)-configuration enester triazole compounds | 陕西师范大学 | 2018-12-14 | — | — | CN | disclosed |