Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTSR1 | P30989 | 3/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.30 |
| ▸ | CD40 | P25942 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23736268 | 0.89 | NTSR1 (0.32) | NTSR1CD40 | |
| SCHEMBL23314633 | 0.88 | NTSR1 (0.31) | NTSR1SRC | |
| SCHEMBL18681550 | 0.88 | CD40 (0.32) | NTSR1CD40 | |
| SCHEMBL18681700 | 0.86 | CPB2 (0.32) | CD40 | |
| SCHEMBL15727155 | 0.85 | SLC6A5 (0.36) | NTSR1CD40 | |
| SCHEMBL18681265 | 0.85 | CD40 (0.32) | CD40 | |
| SCHEMBL15279898 | 0.84 | — | — | |
| SCHEMBL18681356 | 0.84 | — | — | |
| SCHEMBL17282933 | 0.83 | ITGB3 (0.34) | — | |
| SCHEMBL17282847 | 0.83 | ITGB3 (0.34) | — |
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-3145944-B1 | MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS | RQX PHARMACEUTICALS INC (US) | 2021-05-05 | — | — | EP | disclosed |