Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1626918 | 0.82 | ESR1 (0.44) | ESR1ESR2MEN1KMT2ACCR1 | |
| SCHEMBL10193733 | 0.81 | ESR1 (0.43) | ESR1ESR2MEN1KMT2ACCR1 | |
| SCHEMBL10688902 | 0.81 | ESR1 (0.47) | ESR1ESR2MEN1KMT2ACCR1 | |
| SCHEMBL10692824 | 0.76 | CYP19A1 (0.37) | MEN1KMT2ACCR1NPSR1CYP19A1 | |
| SCHEMBL27671400 | 0.75 | KMT2A (0.48) | MEN1KMT2ANPSR1CYP19A1SLC6A2 | |
| SCHEMBL3413029 | 0.73 | MEN1 (0.50) | ESR1ESR2MEN1KMT2ANPSR1 | |
| SCHEMBL8445728 | 0.72 | CCR1 (0.43) | ESR1ESR2MEN1KMT2ACCR1 | |
| SCHEMBL11477882 | 0.72 | ESR1 (0.40) | ESR1ESR2MEN1KMT2ACCR1 | |
| SCHEMBL10213082 | 0.70 | KMT2A (0.54) | MEN1KMT2ACYP19A1POLB | |
| SCHEMBL7863860 | 0.69 | KMT2A (0.58) | MEN1KMT2ANPSR1CYP19A1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0261073-A2 | Insecticidal and acaricidal alkane and alkoxy alkane derivatives | SCHERING AKTIENGESELLSCHAFT (DE) | 1988-03-23 | — | — | EP | disclosed |
| CN-87105707-A | Desinsection and the alkane and the alkoxy derivatives alkane that kill mite | — | 1988-03-09 | — | — | CN | disclosed |