Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 3/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | YWHAG | P61981 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 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 | |
|---|---|---|---|---|
| SCHEMBL17030563 | 0.78 | PTPN1 (0.31) | QDPRALOX5PTPN1AR | |
| SCHEMBL10282755 | 0.72 | QDPR (0.73) | QDPRALOX5PTPN1APPMEN1 | |
| SCHEMBL108606 | 0.72 | QDPR (0.73) | QDPRALOX5PTPN1APPMEN1 | |
| SCHEMBL15095470 | 0.69 | MEN1 (0.50) | ARMEN1GAAKMT2ACA1 | |
| SCHEMBL2719092 | 0.69 | MEN1 (0.50) | ARMEN1GAAKMT2ACA1 | |
| SCHEMBL21816756 | 0.69 | AR (0.72) | QDPRALOX5PTPN1ARAPP | |
| SCHEMBL15259264 | 0.69 | QDPR (0.57) | QDPRALOX5PTPN1ARAPP | |
| SCHEMBL12251167 | 0.69 | QDPR (0.44) | QDPRALOX5PTPN1ARAPP | |
| SCHEMBL107972 | 0.69 | QDPR (0.57) | QDPRALOX5PTPN1ARAPP | |
| SCHEMBL107998 | 0.69 | MEN1 (0.56) | QDPRALOX5PTPN1MEN1POLB |
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-2016065-B1 | 1-(BENZO[D][1,3]DIOXOL-5-YL)-N-(PHENYL)CYCLOPROPANE-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS FOR THE TREATMENT OF CYSTIC FIBROSIS | VERTEX PHARMA (US) | 2012-09-19 | — | — | EP | disclosed |