Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.37 |
| ▸ | HTR2C | P28335 | 3/20 | 0.37 |
| ▸ | HTR2B | P41595 | 3/20 | 0.37 |
| ▸ | HRH2 | P25021 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KDM2B | Q8NHM5 | 3/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3824673 | 0.71 | HTR2A (0.39) | HTR2AHTR2CHTR2BHRH2ALDH1A1 | |
| SCHEMBL3206044 | 0.70 | CHEK2 (0.50) | RAB9AHTR2AHTR2CHTR2BKDM4E | |
| SCHEMBL3563776 | 0.67 | GRIK1 (0.43) | RAB9AHTR2AHTR2CHTR2BHRH2 | |
| SCHEMBL7290141 | 0.66 | KDM4E (0.51) | HTR2AHTR2CHTR2BALDH1A1KDM4E | |
| SCHEMBL11769955 | 0.66 | SMN1; SMN2 (0.55) | RAB9AALDH1A1HTTKDM4E | |
| SCHEMBL4304889 | 0.66 | PPARG (0.55) | HTR2AHTR2CHTR2BKDM4E | |
| SCHEMBL3196231 | 0.66 | DRD3 (0.50) | HTR2AHTR2CHTR2BHRH2ALDH1A1 | |
| SCHEMBL6043905 | 0.65 | KDM4E (0.47) | RAB9AALDH1A1KDM4E | |
| SCHEMBL10848345 | 0.65 | KDM4E (0.47) | RAB9AALDH1A1KDM4E | |
| SCHEMBL2454085 | 0.64 | PPARG (0.56) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1819693-B1 | ANTITHROMBOTIC DIAMIDES | LILLY CO ELI (US) | 2009-08-26 | — | — | EP | disclosed |