Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | PRMT5 | O14744 | 3/20 | 0.42 |
| ▸ | WDR77 | Q9BQA1 | 3/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESRRG | P62508 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086245 | 0.84 | HDAC6 (0.43) | KDM1AHDAC6PRMT5WDR77SMN1; SMN2 | |
| SCHEMBL19086218 | 0.84 | KDM1A (0.48) | KDM1AHDAC6NPC1RAB9APRMT5 | |
| SCHEMBL19086315 | 0.83 | KDM1A (0.47) | KDM1AHDAC6NPC1RAB9APRMT5 | |
| SCHEMBL19087005 | 0.82 | KDM1A (0.41) | KDM1AHDAC6PRMT5WDR77SMN1; SMN2 | |
| SCHEMBL19086189 | 0.81 | PRMT5 (0.48) | KDM1AHDAC6PRMT5WDR77SMN1; SMN2 | |
| SCHEMBL19086204 | 0.81 | ALDH1A1 (0.43) | KDM1AHDAC6RAB9APRMT5WDR77 | |
| SCHEMBL19086019 | 0.81 | ALDH1A1 (0.41) | KDM1AHDAC6RAB9APRMT5WDR77 | |
| SCHEMBL19087013 | 0.81 | KDM1A (0.46) | KDM1AHDAC6PRMT5WDR77SMN1; SMN2 | |
| SCHEMBL19086203 | 0.80 | PRMT5 (0.40) | KDM1AHDAC6PRMT5WDR77SMN1; SMN2 | |
| SCHEMBL19087010 | 0.80 | KDM1A (0.41) | KDM1AHDAC6PRMT5WDR77SMN1; SMN2 |
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 |