Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 3/20 | 0.38 |
| ▸ | CTSS | P25774 | 3/20 | 0.38 |
| ▸ | CTSK | P43235 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | KIT | P10721 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8121379 | 0.76 | CTSB (0.68) | CTSBCTSSCTSKKCNH2 | |
| SCHEMBL4573929 | 0.72 | DRD2 (0.40) | — | |
| SCHEMBL2531232 | 0.70 | KDM4E (0.50) | ALDH1A1MAPK1HSD17B10HPGDKDM4E | |
| SCHEMBL4573200 | 0.70 | CTSK (0.57) | CTSBCTSSCTSKKCNH2 | |
| SCHEMBL4586118 | 0.69 | CTSB (0.42) | CTSBCTSSCTSKKCNH2 | |
| SCHEMBL4573939 | 0.69 | SLC6A9 (0.48) | CTSBCTSSCTSKKCNH2 | |
| SCHEMBL4573148 | 0.69 | GRIA1 (0.49) | SMN1; SMN2MAPK1LMNAMAPTRET | |
| SCHEMBL4573950 | 0.69 | CTSS (0.45) | ALDH1A1SMN1; SMN2CTSBCTSSCTSK | |
| SCHEMBL4573119 | 0.68 | SLC6A9 (0.40) | CTSBCTSSCTSKKCNH2LMNA | |
| SCHEMBL2530660 | 0.68 | RCE1 (0.53) | ALDH1A1SMN1; SMN2MAPK1KDM1AHSD17B10 |
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 |