Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 16/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28710759 | 0.78 | RAB9A (0.56) | HDAC6MAPTTP53RAB9ASMN1; SMN2 | |
| SCHEMBL28713901 | 0.78 | MAPT (0.37) | HDAC6HDAC3HDAC8HDAC1HDAC2 | |
| SCHEMBL23012571 | 0.76 | MAPT (0.60) | MAPTTP53RAB9ASMN1; SMN2POLB | |
| SCHEMBL28936032 | 0.73 | AGPAT2 (0.47) | MAPTTP53RAB9ASMN1; SMN2POLB | |
| SCHEMBL23012293 | 0.70 | NPC1 (0.46) | MAPTTP53RAB9ASMN1; SMN2POLB | |
| SCHEMBL31165934 | 0.68 | RAB9A (0.58) | HDAC6MAPTTP53RAB9ASMN1; SMN2 | |
| SCHEMBL5641647 | 0.67 | HDAC6 (0.62) | HDAC6HDAC3HDAC8HDAC1HDAC2 | |
| SCHEMBL27170152 | 0.67 | HDAC6 (0.41) | HDAC6HDAC3HDAC8HDAC1HDAC2 | |
| SCHEMBL27170147 | 0.67 | HDAC6 (0.41) | HDAC6HDAC3HDAC8HDAC1HDAC2 | |
| SCHEMBL23033512 | 0.66 | NPC1 (0.61) | MAPTTP53RAB9ASMN1; SMN2POLB |
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-2021032209-A1 | ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF | 四川海思科制药有限公司 | 2021-02-25 | — | — | WO | disclosed |