Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PRNP | P04156 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.41 |
| ▸ | PDE7A | Q13946 | 3/20 | 0.40 |
| ▸ | KDM1A | O60341 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086200 | 0.84 | HDAC6 (0.48) | HDAC6NPC1RAB9APRNPALDH1A1 | |
| SCHEMBL19086221 | 0.83 | HDAC6 (0.43) | HDAC6NPC1RAB9APRNPALDH1A1 | |
| SCHEMBL19086049 | 0.77 | ROCK2 (0.43) | HDAC6PRMT5WDR77 | |
| SCHEMBL19086175 | 0.77 | HDAC6 (0.47) | HDAC6NPC1RAB9AALDH1A1PRMT5 | |
| SCHEMBL19086017 | 0.76 | HDAC6 (0.36) | HDAC6PRMT5WDR77KDM1A | |
| SCHEMBL19086018 | 0.73 | ROCK2 (0.44) | HDAC6KMT2A | |
| SCHEMBL19086195 | 0.73 | KDM1A (0.41) | HDAC6NPC1RAB9APRNPALDH1A1 | |
| SCHEMBL19086184 | 0.71 | HDAC6 (0.37) | HDAC6NPC1RAB9APRNPPRMT5 | |
| SCHEMBL19086206 | 0.71 | HDAC6 (0.38) | HDAC6PRMT5WDR77KDM1AKMT2A | |
| SCHEMBL19086352 | 0.71 | HDAC6 (0.40) | HDAC6NPC1RAB9APRNPPRMT5 |
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-2017114275-A1 | COMPOUND FOR INHIBITING ROCK, PREPARATION METHOD AND USE OF SAME | 成都先导药物开发有限公司 | 2017-07-06 | — | — | WO | disclosed |