Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 6/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | AXL | P30530 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | ULK1 | O75385 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18495140 | 0.79 | ELANE (0.40) | CYP11B2CYP11B1KDM4EALDH1A1MAPT | |
| SCHEMBL17228307 | 0.79 | CYP3A4 (0.42) | CYP11B2CYP11B1KDM4EALDH1A1MAPT | |
| SCHEMBL18477492 | 0.77 | CYP11B2 (0.36) | CYP11B2CYP11B1KDM4EALDH1A1MAPT | |
| SCHEMBL18848566 | 0.77 | PDPK1 (0.34) | KDM4EALDH1A1 | |
| SCHEMBL18599581 | 0.76 | ROCK2 (0.35) | CYP11B2CYP11B1 | |
| SCHEMBL11142241 | 0.73 | CYP11B2 (0.55) | CYP11B2CYP11B1KDM4EALDH1A1MAPT | |
| SCHEMBL17228312 | 0.72 | TDP1 (0.42) | KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL17228308 | 0.72 | SLC22A12 (0.37) | CYP11B2CYP11B1CYP17A1 | |
| SCHEMBL18599582 | 0.72 | AHR (0.35) | KDM4EALDH1A1MAPT | |
| SCHEMBL18599583 | 0.72 | ROCK2 (0.37) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3138843-A1 | ISOQUINOLINESULFONYL DERIVATIVE AS RHO KINASE INHIBITOR | Medshine Discovery Inc. (CN) | 2017-03-08 | — | — | EP | disclosed |