Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13529715 | 0.85 | KDM4E (0.44) | KDM4EALDH1A1SMN1; SMN2TSHRMEN1 | |
| SCHEMBL20406240 | 0.76 | KDM4E (0.48) | KDM4EALDH1A1SMN1; SMN2TSHRMEN1 | |
| SCHEMBL2846140 | 0.74 | TSHR (0.60) | KDM4EALDH1A1SMN1; SMN2TSHRMEN1 | |
| SCHEMBL13736023 | 0.74 | TSHR (0.52) | KDM4EALDH1A1SMN1; SMN2TSHRGAA | |
| SCHEMBL17133440 | 0.74 | ALDH1A1 (0.48) | KDM4EALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL18985318 | 0.74 | RXRA (0.40) | GAAHSD17B10TP53NPC1RAB9A | |
| SCHEMBL9460319 | 0.72 | TSHR (0.54) | KDM4EALDH1A1SMN1; SMN2TSHRMEN1 | |
| SCHEMBL315714 | 0.72 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2TSHRMEN1 | |
| SCHEMBL1992777 | 0.71 | RAB9A (0.60) | KDM4EALDH1A1SMN1; SMN2TSHRHSD17B10 | |
| SCHEMBL1333456 | 0.71 | ALDH1A1 (0.45) | KDM4EALDH1A1SMN1; SMN2MEN1KMT2A |
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-2562163-A1 | 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES | Dow AgroSciences LLC (US) | 2013-02-27 | — | — | EP | disclosed |