Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.50 |
| ▸ | AMY1A | P0DUB6 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13160197 | 0.83 | HDAC3 (0.65) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL12763751 | 0.81 | MAPT (0.62) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL28116651 | 0.81 | NPC1 (0.63) | AMY1AMAPTSMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL28116665 | 0.77 | ALDH1A1 (0.58) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL15945341 | 0.77 | SCN10A (0.59) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL12763752 | 0.76 | NPC1 (0.67) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL27983509 | 0.75 | ALDH1A1 (0.63) | HDAC6MAPTSMN1; SMN2TP53MEN1 | |
| SCHEMBL13183515 | 0.74 | NPC1 (0.66) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL9925390 | 0.72 | HDAC3 (0.60) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL25521792 | 0.72 | SMN1; SMN2 (0.55) | HDAC6MAPTSMN1; SMN2TP53MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104072425-B | Benzimidazole compound and application thereof | 大连理工大学 | 2016-12-07 | — | — | CN | claimed |
| CN-104072425-B | Benzimidazole compound and application thereof | 大连理工大学 | 2016-12-07 | — | — | CN | disclosed |