Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | CLPP | Q16740 | 3/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2237372 | 0.88 | NR3C1 (0.45) | NR3C1SIGMAR1ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL1618300 | 0.82 | NR3C1 (0.48) | NR3C1ALDH1A1KDM4ECYP2D6TACR1 | |
| SCHEMBL21465773 | 0.75 | CYP2D6 (0.46) | NR3C1ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL12487550 | 0.72 | ABL1 (0.45) | NR3C1ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL5265856 | 0.70 | CYP2D6 (0.44) | NR3C1SIGMAR1ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL5265862 | 0.70 | CYP2D6 (0.44) | NR3C1SIGMAR1ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL15710575 | 0.70 | KDM4E (0.50) | ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL3140906 | 0.70 | KDM4E (0.46) | SIGMAR1ALDH1A1KDM4EDRD4TACR1 | |
| SCHEMBL5233110 | 0.70 | CYP2D6 (0.43) | NR3C1ALDH1A1KDM4ECYP2D6TACR1 | |
| SCHEMBL5233107 | 0.70 | CYP2D6 (0.43) | NR3C1ALDH1A1KDM4ECYP2D6TACR1 |
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-2011101804-A1 | PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS | GENKYOTEX SA (CH) | 2011-08-25 | — | — | WO | disclosed |