Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 2/20 | 0.40 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | GABRE | P78334 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.33 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.33 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.33 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17662636 | 0.77 | NUDT1 (0.43) | NUDT1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL25721921 | 0.76 | GABRP (0.33) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL19120868 | 0.75 | NUDT1 (0.42) | NUDT1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL17658866 | 0.75 | NUDT1 (0.42) | NUDT1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL19122030 | 0.74 | NUDT1 (0.45) | NUDT1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL23034524 | 0.72 | NUDT1 (0.40) | NUDT1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL17658980 | 0.72 | NUDT1 (0.40) | NUDT1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL25706761 | 0.72 | NUDT1 (0.40) | NUDT1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL25722834 | 0.71 | JMJD6 (0.35) | — | |
| SCHEMBL17647412 | 0.70 | NUDT1 (0.38) | NUDT1GABRPGABRDGABRA1GABRB1 |
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-3436446-B1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMA (US) | 2023-06-07 | — | — | EP | disclosed |