Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | GSTK1 | Q9Y2Q3 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 2/20 | 0.39 |
| ▸ | GABRD | O14764 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.39 |
| ▸ | GABRE | P78334 | 2/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.39 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10379813 | 0.85 | NOD1 (0.47) | NOD1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29351135 | 0.84 | GNPAT (0.45) | NOD1KEAP1GLO1PTGS1GSTK1 | |
| SCHEMBL30930177 | 0.84 | GLO1 (0.42) | NOD1GLO1PTGS1GSTK1DPP4 | |
| SCHEMBL31571919 | 0.83 | NOD1 (0.44) | NOD1GLO1PTGS1GSTK1DPP4 | |
| SCHEMBL31332141 | 0.83 | FOLH1 (0.41) | NOD1GLO1PTGS1GSTK1APC | |
| SCHEMBL29352968 | 0.83 | FOLH1 (0.41) | NOD1GLO1PTGS1GSTK1APC | |
| SCHEMBL9348762 | 0.83 | FOLH1 (0.43) | NOD1GLO1FOLH1RIMKLANAALAD2 | |
| SCHEMBL9348776 | 0.83 | FOLH1 (0.43) | NOD1GLO1FOLH1RIMKLANAALAD2 | |
| SCHEMBL31678954 | 0.82 | PTGS1 (0.46) | NOD1KEAP1GLO1PTGS1GSTK1 | |
| SCHEMBL30964515 | 0.81 | CTSC (0.48) | NOD1GLO1PTGS1GSTK1FOLH1 |
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-2023288213-A1 | MACROCYCLIC IMMUNOMODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2023-01-19 | — | — | WO | disclosed |