Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | GNRHR | P30968 | 1/20 | 0.35 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2347548 | 0.88 | KMT2A (0.51) | KMT2ASLC6A5MEN1GAAATM | |
| SCHEMBL2344993 | 0.85 | CLPP (0.49) | KMT2ADRD2DRD4DRD3CHRM3 | |
| SCHEMBL2349760 | 0.82 | DRD4 (0.44) | KMT2ASLC6A5MEN1GAAATM | |
| SCHEMBL2347846 | 0.82 | COMT (0.41) | — | |
| SCHEMBL2345757 | 0.80 | KMT2A (0.40) | KMT2ASLC6A5MEN1GAAATM | |
| SCHEMBL6911739 | 0.78 | SLC6A5 (0.42) | KMT2ASLC6A5MEN1GAAATM | |
| SCHEMBL6910949 | 0.77 | CHRM2 (0.42) | KMT2ASLC6A5MEN1GAAATM | |
| SCHEMBL6908510 | 0.76 | ACHE (0.46) | KMT2ASLC6A5MEN1CHRM2CHRM3 | |
| SCHEMBL2349611 | 0.76 | MEN1 (0.48) | KMT2ASLC6A5MEN1GAAATM | |
| SCHEMBL2358094 | 0.76 | SIGMAR1 (0.56) | KMT2ASLC6A5DRD2DRD4DRD3 |
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 |