Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | LSS | P48449 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLB1 | P16278 | 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 | |
|---|---|---|---|---|
| SCHEMBL2449584 | 1.00 | CYP1A2 (0.58) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL42810 | 1.00 | CYP1A2 (0.58) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL8914904 | 0.93 | CYP1A2 (0.52) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL27801936 | 0.93 | CYP1A2 (0.52) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL6748553 | 0.93 | CYP1A2 (0.52) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL6746516 | 0.93 | CYP1A2 (0.52) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL8914908 | 0.93 | CYP1A2 (0.52) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL1469972 | 0.93 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL1992737 | 0.93 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL4840189 | 0.91 | CYP1A2 (0.68) | CYP1A2HTTLMNAMAPK1MAPT |
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-2562175-A1 | 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES | Dow AgroSciences LLC (US) | 2013-02-27 | — | — | EP | disclosed |