Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 19/20 | 0.60 |
| ▸ | MAOB | P27338 | 1/20 | 0.58 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.56 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.56 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.56 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.56 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.56 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.56 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.56 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL398990 | 0.87 | CFTR (0.63) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL394741 | 0.87 | CFTR (0.56) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL397635 | 0.87 | CFTR (0.62) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL13923966 | 0.84 | CFTR (0.53) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL395893 | 0.84 | CFTR (0.53) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL399193 | 0.84 | CFTR (0.53) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL398653 | 0.82 | CFTR (0.71) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL10256128 | 0.82 | CFTR (0.71) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL15070936 | 0.81 | CFTR (0.62) | CFTRMAOBGABRA1GABRB1GABRA5 | |
| SCHEMBL22417538 | 0.81 | CFTR (0.51) | CFTRMAOBGABRA1GABRB1GABRA5 |
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-2011072241-A9 | 4-OXO-1H-QUINOLINE-3-CARBOXAMIDES AS MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-06-14 | — | — | WO | disclosed |