Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 4/20 | 0.57 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.57 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.57 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.57 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.57 |
| ▸ | MC4R | P32245 | 1/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.57 |
| ▸ | NR2E1 | Q9Y466 | 3/20 | 0.45 |
| ▸ | PABPC1 | P11940 | 3/20 | 0.45 |
| ▸ | EIF4H | Q15056 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | RORA | P35398 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Ivacaftor SCHEMBL417309 | 0.85 | CFTR (0.56) | CFTRADORA3ADRB3TBXA2RSLC6A2 | |
| SCHEMBL18617160 | 0.83 | CFTR (0.54) | CFTRADORA3ADRB3TBXA2RSLC6A2 | |
| SCHEMBL25874770 | 0.78 | CFTR (0.49) | CFTRADORA3ADRB3TBXA2RSLC6A2 | |
| SCHEMBL15244981 | 0.75 | CFTR (0.45) | CFTRADORA3ADRB3TBXA2RSLC6A2 | |
| SCHEMBL28586487 | 0.75 | SIRT6 (0.57) | CFTRADORA3ADRB3TBXA2RSLC6A2 | |
| SCHEMBL28573860 | 0.74 | KDM4E (0.75) | MEN1KMT2AMAPTLMNAKDM4E | |
| SCHEMBL24688078 | 0.73 | RXFP1 (0.58) | NR2E1KMT2AMAPTHSD17B10LMNA | |
| SCHEMBL30102526 | 0.73 | RXFP1 (0.58) | NR2E1KMT2AMAPTHSD17B10LMNA | |
| Ivacaftor SCHEMBL29379239 | 0.73 | CFTR (1.00) | CFTRADORA3ADRB3TBXA2RSLC6A2 | |
| Ivacaftor SCHEMBL29357389 | 0.73 | CFTR (1.00) | CFTRADORA3ADRB3TBXA2RSLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3068392-A1 | PROCESS OF PREPARING PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF CFTR MEDIATED DISEASES | Vertex Pharmaceuticals Inc. (US) | 2016-09-21 | — | — | EP | disclosed |
| WO-2015073231-A9 | PROCESS OF PREPARING PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF CFTR MEDIATED DISEASES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-07-16 | — | — | WO | disclosed |
| WO-2015073231-A1 | PROCESS OF PREPARING PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF CFTR MEDIATED DISEASES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-05-21 | — | — | WO | disclosed |