Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CLPP | Q16740 | 2/20 | 0.45 |
| ▸ | BRS3 | P32247 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | TACR1 | P25103 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2349570 | 0.88 | CNR2 (0.44) | KDM4EALDH1A1GAALMNABRS3 | |
| SCHEMBL2346409 | 0.81 | TACR1 (0.45) | KDM4EALDH1A1GAALMNACLPP | |
| SCHEMBL6911024 | 0.80 | BRS3 (0.44) | KDM4EALDH1A1GAALMNACLPP | |
| SCHEMBL2356534 | 0.76 | TACR1 (0.46) | KDM4EALDH1A1GAALMNACLPP | |
| SCHEMBL2343382 | 0.75 | UBE2M (0.41) | KDM4EALDH1A1GAALMNACLPP | |
| SCHEMBL2349473 | 0.74 | MEN1 (0.53) | GAACLPPDRD2DRD3KCNH2 | |
| SCHEMBL2439744 | 0.74 | KDM4E (0.62) | KDM4EALDH1A1GAALMNABRS3 | |
| SCHEMBL6910475 | 0.74 | KMT2A (0.41) | KDM4EALDH1A1GAADRD2DRD3 | |
| SCHEMBL2351683 | 0.73 | MEN1 (0.53) | GAACLPPDRD2DRD3KCNH2 | |
| SCHEMBL2348073 | 0.73 | SLC6A5 (0.60) | KDM4EALDH1A1GAACLPPDRD2 |
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-2011101805-A1 | PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS | GENKYOTEX SA (CH) | 2011-08-25 | — | — | WO | disclosed |