Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 11/20 | 0.71 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | ECE1 | P42892 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14403600 | 0.90 | CFTR (0.73) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL23506802 | 0.89 | CFTR (0.74) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL19753065 | 0.89 | CFTR (0.82) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL23506709 | 0.87 | CFTR (0.85) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL19752871 | 0.86 | CFTR (0.71) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL20194863 | 0.84 | CFTR (0.69) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL14403846 | 0.84 | CFTR (0.82) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL14403579 | 0.84 | CFTR (0.73) | CFTRHTR2APDE4DSCN5ATHRA | |
| SCHEMBL14403559 | 0.83 | CFTR (0.75) | CFTRHTR2APDE4DSCN5AHDAC1 | |
| SCHEMBL1466013 | 0.83 | CFTR (1.00) | CFTRHTR2APDE4DSCN5AHDAC1 |
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-2007117715-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-10-18 | — | — | WO | disclosed |