Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 9/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.41 |
| ▸ | POLQ | O75417 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4596299 | 0.87 | AR (0.35) | ARSLC22A12POLQCYP1A2CYP2D6 | |
| SCHEMBL8109165 | 0.80 | HDAC3 (0.38) | AR | |
| SCHEMBL837308 | 0.79 | TSHR (0.52) | MEN1KMT2A | |
| SCHEMBL803427 | 0.79 | RAB9A (0.41) | POLQCYP1A2CYP2D6CYP2C19RAB9A | |
| SCHEMBL2814890 | 0.79 | GAA (0.50) | ARKDM4EMEN1ALDH1A1GLA | |
| SCHEMBL4474145 | 0.79 | KDM1A (0.39) | AR | |
| SCHEMBL3789153 | 0.78 | CYP3A4 (0.52) | ARPOLQCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL20382700 | 0.78 | CYP3A4 (0.41) | MEN1LMNAKMT2A | |
| SCHEMBL950544 | 0.76 | AR (0.68) | ARSLC22A12 | |
| SCHEMBL3919628 | 0.75 | AR (0.43) | ARSLC22A12ALDH1A1 |
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 2 patents. 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 |
| WO-2009001127-A1 | CYANOCYCLOPROPYLCARBOXAMIDES AS CATHEPSIN INHIBITORS | ASTRAZENECA AB (SE) | 2008-12-31 | — | — | WO | disclosed |