Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 6/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12107538 | 0.88 | CYP3A4 (0.54) | CYP3A4ALDH1A1NPSR1RAPGEF4ESR1 | |
| SCHEMBL14649874 | 0.84 | CYP3A4 (0.47) | CYP3A4ALDH1A1NPSR1ESR1ESR2 | |
| SCHEMBL20257529 | 0.84 | RAPGEF4 (0.41) | SOS1CYP3A4ALDH1A1RAPGEF4PIK3CA | |
| SCHEMBL12706760 | 0.82 | CYP3A4 (0.48) | CYP3A4ALDH1A1NPSR1RAPGEF4ESR1 | |
| SCHEMBL14397402 | 0.80 | CYP3A4 (0.47) | CYP3A4ALDH1A1NPSR1RAPGEF4ESR1 | |
| SCHEMBL14922686 | 0.79 | TAAR1 (0.49) | CYP3A4 | |
| SCHEMBL19002430 | 0.79 | PNMT (0.46) | CYP3A4ALDH1A1ESR1ESR2CYP2C19 | |
| SCHEMBL253442 | 0.78 | CALM1 (0.48) | CYP3A4ESR1ESR2KDM4ECYP2C19 | |
| SCHEMBL1043112 | 0.78 | CALM1 (0.48) | CYP3A4PIK3CAPARP1CYP2C19HIF1A | |
| SCHEMBL8137220 | 0.78 | ALDH1A1 (0.39) | SOS1CYP3A4ALDH1A1RAPGEF4PIK3CA |
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-2007113327-A2 | FUNGICIDE N-CYCLOPROPYL-SULFONYLAMIDE DERIVATIVES | BAYER CROPSCIENCE SA (FR) | 2007-10-11 | — | — | WO | disclosed |