Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | BCL2A1 | Q16548 | 2/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | GHSR | Q92847 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CCND3 | P30281 | 1/20 | 0.36 |
| ▸ | CDK6 | Q00534 | 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 | |
|---|---|---|---|---|
| SCHEMBL20158997 | 0.88 | KHK (0.49) | KHKMAPTADRB1BCL2A1HSD11B1 | |
| SCHEMBL20159005 | 0.88 | MAPT (0.49) | KHKMAPTBCL2A1HSD11B1GHSR | |
| SCHEMBL8110875 | 0.88 | MAPT (0.49) | KHKMAPTBCL2A1HSD11B1GHSR | |
| SCHEMBL8108416 | 0.84 | BCL2A1 (0.52) | KHKMAPTADRB1BCL2A1HSD11B1 | |
| SCHEMBL23744806 | 0.83 | GHSR (0.52) | GHSR | |
| SCHEMBL12208547 | 0.82 | BCL2A1 (0.53) | KHKMAPTADRB1BCL2A1HSD11B1 | |
| SCHEMBL8110949 | 0.81 | TLR9 (0.45) | KHKMAPTBCL2A1GHSRTLR9 | |
| SCHEMBL31084546 | 0.81 | MAPT (0.46) | KHKMAPTBCL2A1HSD11B1ALDH1A1 | |
| SCHEMBL28283045 | 0.81 | MAPT (0.46) | KHKMAPTBCL2A1HSD11B1ALDH1A1 | |
| SCHEMBL8108460 | 0.81 | BCL2A1 (0.55) | KHKMAPTADRB1BCL2A1HSD11B1 |
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-2009001127-A1 | CYANOCYCLOPROPYLCARBOXAMIDES AS CATHEPSIN INHIBITORS | ASTRAZENECA AB (SE) | 2008-12-31 | — | — | WO | disclosed |