Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 5/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 3/20 | 0.37 |
| ▸ | KDR | P35968 | 3/20 | 0.37 |
| ▸ | TEK | Q02763 | 3/20 | 0.37 |
| ▸ | SRC | P12931 | 3/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.35 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20162780 | 1.00 | CFTR (0.51) | CFTRPTGS2NOTUMLCKKDR | |
| SCHEMBL20162726 | 0.87 | CFTR (0.49) | CFTRPTGS2NOTUMLCKKDR | |
| SCHEMBL30037914 | 0.87 | CFTR (0.49) | CFTRPTGS2NOTUMLCKKDR | |
| SCHEMBL20163113 | 0.84 | RXRA (0.44) | CFTRPTGS2NOTUMSRCRXRA | |
| SCHEMBL20162774 | 0.75 | CFTR (0.59) | CFTR | |
| SCHEMBL30037490 | 0.75 | CFTR (0.59) | CFTR | |
| SCHEMBL20162690 | 0.74 | CFTR (0.46) | CFTRLCKKDRTEKSRC | |
| SCHEMBL30038267 | 0.74 | CFTR (0.46) | CFTRLCKKDRTEKSRC | |
| SCHEMBL20182215 | 0.73 | NOTUM (0.48) | CFTRPTGS2NOTUMRXRAGRIN1 | |
| SCHEMBL20173309 | 0.73 | NOTUM (0.48) | CFTRPTGS2NOTUMSRCRXRA |
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-3541390-B1 | PYRROLOPYRIMIDINES AS CFTR POTENTIATORS | CYSTIC FIBROSIS FOUND (US) | 2024-05-01 | — | — | EP | disclosed |