Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939135 | 0.83 | ALDH1A1 (0.40) | PARP10PARP11CA1CA2CA7 | |
| SCHEMBL14939641 | 0.83 | MAPT (0.34) | CDK5CFTRGOPCGAAMAPT | |
| SCHEMBL14938950 | 0.83 | SRD5A1 (0.36) | CA1CA2CA7CA9CFTR | |
| SCHEMBL14939637 | 0.79 | ACHE (0.43) | CA1CA2CA7CA9MAPT | |
| SCHEMBL14938940 | 0.76 | NPSR1 (0.49) | CFTRGOPCGAAMAPTRAB9A | |
| SCHEMBL22989994 | 0.73 | CDK5 (0.44) | CDK5PIM1CSNK1A1ROCK1DYRK1A | |
| SCHEMBL25003063 | 0.73 | CDK5 (0.44) | CDK5PIM1CSNK1A1ROCK1DYRK1A | |
| SCHEMBL29237779 | 0.70 | CDK5 (0.42) | CDK5PIM1CSNK1A1ROCK1DYRK1A | |
| SCHEMBL14939470 | 0.70 | L3MBTL1 (0.41) | LRRK2PARP10PARP11CA1CA2 | |
| SCHEMBL14938921 | 0.70 | TDP1 (0.47) | CDK5LRRK2PARP10CA1CA2 |
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-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |